SCHEMBL628830

SCHEMBL628830

C1CCN(c2nnn[nH]2)C1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
PIM1 P11309 1/20 0.33
BCHE P06276 1/20 0.32
ACHE P22303 1/20 0.32
HRH1 P35367 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
HPGD P15428 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
GFER P55789 1/20 0.31
HSD17B10 Q99714 1/20 0.31
USP2 O75604 1/20 0.31

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
SCHEMBL31759376 0.98 CYP1A2 (0.37) MEN1CYP1A2CYP2C19KMT2APIM1
SCHEMBL5394656 0.98 CYP1A2 (0.37) MEN1CYP1A2CYP2C19KMT2APIM1
SCHEMBL10274656 0.98 CYP1A2 (0.37) MEN1CYP1A2CYP2C19KMT2APIM1
SCHEMBL943173 0.98 CYP1A2 (0.37) MEN1CYP1A2CYP2C19KMT2APIM1
SCHEMBL10493476 0.95
SCHEMBL31759401 0.80 TRPC3 (0.38) MEN1KMT2ATDP1HPGDKDM4E
SCHEMBL31759472 0.80 TRPC3 (0.38) MEN1KMT2ATDP1HPGDKDM4E
SCHEMBL31759418 0.80 TRPC3 (0.38) MEN1KMT2ATDP1HPGDKDM4E
SCHEMBL31759407 0.78 RXFP1 (0.36) MEN1KMT2AHPGDKDM4EALDH1A1
SCHEMBL31759457 0.78 RXFP1 (0.36) MEN1KMT2AHPGDKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11897917-B2 Bioconjugation of polypeptides THE UNIVERSITY OF YORK (GB) 2024-02-13 US claimed
US-20200317723-A1 Bioconjugation of Polypeptides THE UNIVERSITY OF YORK (GB) 2020-10-08 US claimed
US-20100184991-A1 PREPARATION OF TERAZOLE DERIVATIVES SEDELMEIER GOTTFRIED 2010-07-22 US claimed
US-20080200687-A1 Preparation of Terazole Derivatives SEDELMEIER GOTTFRIED 2008-08-21 US claimed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP claimed
US-5473077-A 4-aminopyrrolidine-2,4-substitude independently with carboxylic acid or 5-tetrazolyl for treating nervous system disorders and psychological disorders ELI LILLY AND COMPANY (US) 1995-12-05 US claimed
EP-0346943-B1 DIPHENYL-METHANE DERIVATIVE, PHARMACEUTICAL COMPOSITION AND USE Eisai Co., Ltd. (JP) 1993-02-17 EP claimed
US-20260008768-A1 UREA DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF VENTUS THERAPEUTICS U S INC (US) 2026-01-08 US disclosed
EP-4658667-A1 CYCLIC PEPTIDES FOR INHIBITING TNF RECEPTOR 1 ACTIVITY Merck Sharp & Dohme LLC (US) 2025-12-10 EP disclosed
WO-2024163691-A1 CYCLIC PEPTIDES FOR INHIBITING TNF RECEPTOR 1 ACTIVITY MERCK SHARP & DOHME LLC (US) 2024-08-08 WO disclosed
US-11897917-B2 Bioconjugation of polypeptides THE UNIVERSITY OF YORK (GB) 2024-02-13 US disclosed
US-20200317723-A1 Bioconjugation of Polypeptides THE UNIVERSITY OF YORK (GB) 2020-10-08 US disclosed
EP-3041832-A1 STEREOSELECTIVE SYNTHESIS OF DIOLS AND TRIOLS BY MANNICH REACTION AND THEIR USE IN THE SYNTHESIS OF CARFILZOMIB Sandoz AG (CH) 2016-07-13 EP disclosed
EP-1294707-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2003-03-26 EP disclosed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO disclosed
US-6414013-B1 KINASE INHIBITORS; ANTICANCER AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-07-02 US disclosed
WO-2002012242-A2 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA S.P.A. (IT) 2002-02-14 WO disclosed
WO-2001098290-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA S.P.A. (IT) 2001-12-27 WO disclosed
EP-1124810-A1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA & UPJOHN S.p.A. (IT) 2001-08-22 EP disclosed
WO-2000026202-A1 2-AMINO-THIAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2000-05-11 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 (5 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-20260008768-A1 UREA DERIVATIVES FOR INHIBITING NLRP3 AND USES THEREOF NOD1, NLRP3, NOD2 MEN1 4308/4885CYP1A2 2180/4885CYP2C19 4144/4885
US-20080200687-A1 Preparation of Terazole Derivatives TERB1, TALDO1, TERT MEN1 1883/4885CYP1A2 28/4885CYP2C19 38/4885
US-11897917-B2 Bioconjugation of polypeptides PTMS, EPCAM, IAPP MEN1 493/4885CYP1A2 2893/4885CYP2C19 3789/4885
US-20100184991-A1 PREPARATION OF TERAZOLE DERIVATIVES TERB1, TALDO1, TERT MEN1 1883/4885CYP1A2 28/4885CYP2C19 38/4885
US-20200317723-A1 Bioconjugation of Polypeptides PTMS, EPCAM, IAPP MEN1 493/4885CYP1A2 2893/4885CYP2C19 3789/4885

“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.