SCHEMBL4412012

SCHEMBL4412012

Cc1nnc(-c2ccc(Cl)c(N)c2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
HRH1 P35367 1/20 0.39
TP53 P04637 2/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 8/20 0.37
KDM4E B2RXH2 6/20 0.37
MAPT P10636 6/20 0.37
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
HPGD P15428 4/20 0.37
PKM P14618 2/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
IKBKB O14920 2/20 0.36
GAA P10253 3/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 2/20 0.36

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
SCHEMBL418276 0.84 HRH1 (0.49) HRH1ALDH1A1KDM4EMAPTNPC1
SCHEMBL4411032 0.81 POLB (0.54) MEN1KMT2AHRH1TP53TSHR
SCHEMBL4412067 0.75 MAPT (0.50) MEN1KMT2AALDH1A1MAPTNPBWR1
SCHEMBL415765 0.74 MAPK1 (0.47) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL7119605 0.74 RPS6KA3 (0.45) MEN1KMT2ATP53ALDH1A1KDM4E
SCHEMBL4407294 0.74 ALDH1A1 (0.58) MEN1KMT2ATSHRALDH1A1KDM4E
SCHEMBL416660 0.72 GAA (0.53) HRH1ALDH1A1KDM4EGAAPOLB
SCHEMBL1077128 0.72 NPC1 (0.51) MEN1KMT2ATP53TSHRALDH1A1
Water SCHEMBL17103297 0.71 NPC1 (0.50) MEN1KMT2ATP53TSHRALDH1A1
SCHEMBL4083350 0.71 TSHR (0.39) MEN1KMT2AHRH1TP53TSHR

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1523475-B1 HETEROCYCLICALLY SUBSTITUTED BENZOYLUREAS, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS SANOFI AVENTIS DEUTSCHLAND (DE) 2009-12-23 EP disclosed
CN-1304371-C Heterocyclically substituted benzoylureas, medicaments thereof and use for producing medicaments AVENTIS PHARMA GMBH (DE) 2007-03-14 CN disclosed
US-20070021474-A1 Heterocyclically Substituted Benzoylureas, Process For Their Preparation and Their Use as Pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-01-25 US disclosed
US-7138414-B2 Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-11-21 US disclosed
CN-1668593-A Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals AVENTIS PHARMA GMBH (DE) 2005-09-14 CN disclosed
EP-1523475-A1 HETEROCYCLICALLY SUBSTITUTED BENZOYLUREAS, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS Aventis Pharma Deutschland GmbH (DE) 2005-04-20 EP disclosed
US-20040152743-A1 Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-08-05 US disclosed
WO-2004007455-A1 HETEROCYCLICALLY SUBSTITUTED BENZOYLUREAS, METHOD FOR THEIR PRODUCTION AND THEIR USE AS MEDICAMENTS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-01-22 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 (2 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-20070021474-A1 Heterocyclically Substituted Benzoylureas, Process For Their Preparation and Their Use as Pharmaceuticals SLC5A2, CYP1A2, HBB MEN1 1797/4885KMT2A 2633/4885HRH1 634/4885
US-20040152743-A1 Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals SLC5A2, CYP1B1, CYP2C19 MEN1 1171/4885KMT2A 3209/4885HRH1 537/4885

“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.