SCHEMBL1474975

SCHEMBL1474975

O=C(O)C(=O)c1c[nH]c2ncccc12

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.65
ADORA2A P29274 1/20 0.53
CAMKK2 Q96RR4 2/20 0.52
CNR2 P34972 1/20 0.52
KMT2A Q03164 1/20 0.50
AXL P30530 1/20 0.50
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
CCNE1 P24864 3/20 0.49
CDK2 P24941 3/20 0.49
GPR84 Q9NQS5 1/20 0.49
MET P08581 2/20 0.48
KIF20A O95235 1/20 0.47
CLK1 P49759 1/20 0.47
CLK2 P49760 1/20 0.47
CDK5 Q00535 1/20 0.47
DYRK1A Q13627 1/20 0.47
CDK5R1 Q15078 1/20 0.47
CLK4 Q9HAZ1 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL3595977 0.98 MAP2K1 (0.63) MAP2K1ADORA2ACAMKK2CNR2KMT2A
SCHEMBL985214 0.88 MAP2K1 (0.71) MAP2K1ADORA2ACAMKK2CNR2KMT2A
SCHEMBL29468201 0.88 MAP2K1 (0.71) MAP2K1ADORA2ACAMKK2CNR2KMT2A
Hydrochloric Acid SCHEMBL3608101 0.86 MAP2K1 (0.69) MAP2K1ADORA2ACAMKK2CNR2KMT2A
Potassium Ion SCHEMBL29688228 0.85 MAP2K1 (0.63) MAP2K1ADORA2ACAMKK2CNR2KMT2A
Potassium Ion SCHEMBL2688784 0.85 MAP2K1 (0.63) MAP2K1ADORA2ACAMKK2CNR2KMT2A
SCHEMBL13325426 0.85 MAP2K1 (0.68) MAP2K1ADORA2ACAMKK2CNR2KMT2A
SCHEMBL3595975 0.85 MAP2K1 (0.63) MAP2K1ADORA2ACAMKK2CNR2KMT2A
SCHEMBL1867330 0.85 MAP2K1 (0.63) MAP2K1ADORA2ACAMKK2CNR2KMT2A
SCHEMBL27708260 0.84 MAP2K1 (0.71) MAP2K1ADORA2ACAMKK2CNR2KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 75 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250382266-A1 5-HT2A RECEPTOR LIGANDS PSILERA INC (US) 2025-12-18 US disclosed
WO-2024086682-A2 5-HT2A RECEPTOR LIGANDS PSILERA INC. (US) 2024-04-25 WO disclosed
US-11369624-B2 Salts of prodrugs of piperazine and substituted piperidine antiviral agents VIIV HEALTHCARE UK (NO. 4) LIMITED 2022-06-28 US disclosed
US-20210023098-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS VIIV HEALTHCARE UK NO 4 LTD (GB) 2021-01-28 US disclosed
US-20200046743-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS VIIV HEALTHCARE UK NO 4 LTD (GB) 2020-02-13 US disclosed
US-20190111066-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS VIIV HEALTHCARE UK NO 4 LTD (GB) 2019-04-18 US disclosed
US-20180000849-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS VIIV HEALTHCARE UK (NO 4) LTD (GB) 2018-01-04 US disclosed
US-20180000849-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS VIIV HEALTHCARE UK (NO 4) LTD (GB) 2018-01-04 US disclosed
US-20160361328-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS VIIV HEALTHCARE UK (NO 4) LTD (GB) 2016-12-15 US disclosed
US-20160361328-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS VIIV HEALTHCARE UK (NO 4) LTD (GB) 2016-12-15 US disclosed
WO-2004043337-A2 INDOLE, AZAINDOLE AND RELATED HETEROCYCLIC 4-ALKENYL PIPERIDINE AMIDES BRISTOL-MYERS SQUIBB COMPANY (US) 2004-05-27 WO disclosed
US-20040063744-A1 Indole, azaindole and related heterocyclic 4-alkenyl piperidine amides VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2004-04-01 US disclosed
US-20040023982-A1 Antiviral azaindole derivatives VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2004-02-05 US disclosed
US-6632819-B1 HIV and AIDS BRISTOL-MYERS SQUIBB COMPANY 2003-10-14 US disclosed
WO-2003072028-A2 METHOD OF TREATING HIV INFECTION BY PREVENTING INTERACTION OF CD4 AND GP120 BRISTOL-MYERS SQUIBB COMPANY (US) 2003-09-04 WO disclosed
EP-1257276-A1 ANTIVIRAL AZAINDOLE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2002-11-20 EP disclosed
US-6476034-B2 AIDS THERAPY BRISTOL-MYERS SQUIBB COMPANY 2002-11-05 US disclosed
US-20020119982-A1 Antiviral azaindole derivatives VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2002-08-29 US disclosed
US-20020061892-A1 Antiviral azaindole derivatives VIIV HEALTHCARE UK (NO. 5) LIMITED (GB) 2002-05-23 US disclosed
WO-2001062255-A1 ANTIVIRAL AZAINDOLE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY (US) 2001-08-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (11 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020119982-A1 Antiviral azaindole derivatives ZC3HAV1, MAVS, AZI2 MAP2K1 3885/4885ADORA2A 740/4885CAMKK2 4304/4885
US-20020061892-A1 Antiviral azaindole derivatives ZC3HAV1, MAVS, AZI2 MAP2K1 3885/4885ADORA2A 740/4885CAMKK2 4304/4885
US-20180000849-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS CCR5, ZC3HAV1L, CCRL2 MAP2K1 2634/4885ADORA2A 2152/4885CAMKK2 3569/4885
US-20190111066-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS CCR5, ZC3HAV1L, CCRL2 MAP2K1 2634/4885ADORA2A 2152/4885CAMKK2 3569/4885
US-20040063744-A1 Indole, azaindole and related heterocyclic 4-alkenyl piperidine amides IDO1, IDO2, INMT MAP2K1 3808/4885ADORA2A 216/4885CAMKK2 2809/4885
US-20250382266-A1 5-HT2A RECEPTOR LIGANDS HTR2A, HTR2C, HTR5A MAP2K1 2731/4885ADORA2A 25/4885CAMKK2 616/4885
US-20210023098-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS ZC3HAV1L, CCR5, CCRL2 MAP2K1 2632/4885ADORA2A 2255/4885CAMKK2 3150/4885
US-11369624-B2 Salts of prodrugs of piperazine and substituted piperidine antiviral agents CCR5, ZC3HAV1L, CCRL2 MAP2K1 2634/4885ADORA2A 2152/4885CAMKK2 3569/4885
US-20200046743-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS CCR5, ZC3HAV1L, CCRL2 MAP2K1 2634/4885ADORA2A 2152/4885CAMKK2 3569/4885
US-20040023982-A1 Antiviral azaindole derivatives ZC3HAV1, MAVS, EIF2AK2 MAP2K1 4015/4885ADORA2A 707/4885CAMKK2 4004/4885
US-20160361328-A1 SALTS OF PRODRUGS OF PIPERAZINE AND SUBSTITUTED PIPERIDINE ANTIVIRAL AGENTS CCR5, ZC3HAV1L, CCRL2 MAP2K1 2634/4885ADORA2A 2152/4885CAMKK2 3569/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.