SCHEMBL3290233

SCHEMBL3290233

c1ccc2c(c1)ncn2C1CCNCC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.57
SLC6A4 P31645 1/20 0.57
OPRM1 P35372 1/20 0.53
OPRL1 P41146 1/20 0.53
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
IKZF3 Q9UKT9 1/20 0.51
KMT2A Q03164 1/20 0.50
PRKCI P41743 1/20 0.48
ALDH1A1 P00352 1/20 0.48
JAK2 O60674 1/20 0.48
JAK1 P23458 1/20 0.48
USP2 O75604 1/20 0.47
PKM P14618 1/20 0.47
IRAK4 Q9NWZ3 1/20 0.47
MKNK1 Q9BUB5 1/20 0.46
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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 SCHEMBL4919274 0.98 DRD2 (0.56) DRD2SLC6A4OPRM1OPRL1DDB1
Hydrochloric Acid SCHEMBL7655718 0.98 DRD2 (0.56) DRD2SLC6A4OPRM1OPRL1DDB1
Hydrochloric Acid SCHEMBL29398597 0.98 DRD2 (0.56) DRD2SLC6A4OPRM1OPRL1DDB1
SCHEMBL432010 0.88 DRD2 (0.65) DRD2SLC6A4OPRM1OPRL1DDB1
Trifluoroacetic Acid SCHEMBL6247999 0.87 USP2 (0.47) DRD2SLC6A4OPRM1OPRL1DDB1
Trifluoroacetic Acid SCHEMBL29396555 0.87 USP2 (0.47) DRD2SLC6A4OPRM1OPRL1DDB1
SCHEMBL3931858 0.84 DRD2 (0.61) DRD2SLC6A4OPRM1OPRL1DDB1
SCHEMBL11562405 0.84 DRD2 (0.61) DRD2SLC6A4OPRM1OPRL1DDB1
SCHEMBL6211429 0.83 OPRM1 (0.63) DRD2SLC6A4OPRM1OPRL1DDB1
Hydrochloric Acid SCHEMBL27655028 0.82 USP2 (0.50) DRD2SLC6A4OPRM1OPRL1DDB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4200292-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS Bristol-Myers Squibb Company (US) 2023-06-28 EP claimed
WO-2022040260-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL-MYERS SQUIBB COMPANY (US) 2022-02-24 WO claimed
CN-111848598-B Heterocyclic compound, application thereof and composition containing same 健艾仕生物医药有限公司 2024-12-10 CN disclosed
US-20240391940-A1 FUSED RING-CONTAINING COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME GENEROS BIOPHARMA LTD. (GB) 2024-11-28 US disclosed
EP-4234544-A1 FUSED RING-CONTAINING COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME Generos Biopharma Ltd. (KY) 2023-08-30 EP disclosed
EP-4200292-A1 1H-BENZO[D]IMIDAZOLE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS Bristol-Myers Squibb Company (US) 2023-06-28 EP disclosed
US-20230099441-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME GENEROS BIOPHARMA LTD. (CN) 2023-03-30 US disclosed
US-11420961-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2022-08-23 US disclosed
EP-3717477-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2022-07-20 EP disclosed
CN-114478482-A Compound containing condensed ring, application thereof and composition containing compound 健艾仕生物医药有限公司 2022-05-13 CN disclosed
WO-2022083731-A1 FUSED RING-CONTAINING COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME 健艾仕生物医药有限公司 2022-04-28 WO disclosed
US-5830905-A PHENYLENEDIPYRIDINE DERIVATIVES VIROPHARMA INCORPORATED (US) 1998-11-03 US disclosed
CN-1173132-A Dihydropyrimidine compounds and application thereof SYNAPTIC PHARMACEUTIC CORP (US) 1998-02-11 CN disclosed
WO-1997042956-A1 DIDHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-11-20 WO disclosed
WO-1997040035-A1 1-(4-PIPERIDYL)-BENZIMIDAZOLES HAVING NEUROTROPHIC ACTIVITY NEUROSEARCH A/S (DK) 1997-10-30 WO disclosed
WO-1997040035-A1 1-(4-PIPERIDYL)-BENZIMIDAZOLES HAVING NEUROTROPHIC ACTIVITY NEUROSEARCH A/S (DK) 1997-10-30 WO disclosed
WO-1997036554-A1 PIPERIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS THEREOF AND THEIR USE IN THE TREATMENT OF HEPATITIS C VIROPHARMA INCORPORATED (US) 1997-10-09 WO disclosed
EP-0790826-A1 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-08-27 EP disclosed
WO-1996014846-A1 DIHYDROPYRIMIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1996-05-23 WO disclosed
US-4166853-A Antihypertensive 7-trifluoromethyl-4-aminoquinolones THE UPJOHN COMPANY (US) 1979-09-04 US 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 (3 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-20230099441-A1 HETEROCYCLIC COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME STAT5A, STAT5B, JAK2 DRD2 3735/4885SLC6A4 4195/4885OPRM1 4144/4885
US-11420961-B2 Heterocyclic compounds LPXN, MLX, CCNY DRD2 1811/4885SLC6A4 4397/4885OPRM1 549/4885
US-20240391940-A1 FUSED RING-CONTAINING COMPOUND, APPLICATION THEREOF, AND COMPOSITION CONTAINING SAME STAT5A, STAT5B, JAK2 DRD2 4477/4885SLC6A4 4714/4885OPRM1 4582/4885

“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.