SCHEMBL4412164

SCHEMBL4412164

Cc1cc(=O)n(-c2ccc(N)c(C)c2)[nH]1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.58
▸ MAPT P10636 6/20 0.58
▸ KDM4E B2RXH2 5/20 0.58
▸ KMT2A Q03164 4/20 0.58
▸ GAA P10253 4/20 0.58
▸ HTT P42858 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ LMNA P02545 2/20 0.55
▸ RECQL P46063 1/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ ALKBH5 Q6P6C2 6/20 0.48
▸ THRB P10828 1/20 0.43
▸ RAD52 P43351 2/20 0.41
▸ ALPL P05186 2/20 0.40
▸ ALKBH3 Q96Q83 1/20 0.39
▸ ENPP3 O14638 1/20 0.39
▸ XIAP P98170 1/20 0.39
▸ KDM5A P29375 1/20 0.38
▸ KDM2B Q8NHM5 1/20 0.38

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
SCHEMBL407942 0.84 ALKBH5 (0.64) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL8166341 0.81 ALDH1A1 (0.69) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL11586022 0.80 MAPT (0.62) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL8751489 0.79 ALDH1A1 (0.54) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL8592651 0.77 ALDH1A1 (0.69) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL486125 0.77 MAPT (0.73) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL9815245 0.77 MAPT (0.58) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL7893151 0.77 MAPT (0.54) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL11504634 0.76 ALDH1A1 (0.54) ALDH1A1MAPTKDM4EKMT2AGAA
SCHEMBL4399573 0.75 MAPT (0.53) ALDH1A1MAPTKDM4EKMT2AGAA

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 6 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
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
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 ALDH1A1 435/4885MAPT 4315/4885KDM4E 1717/4885
US-20040152743-A1 Heterocyclically substituted benzoylureas, process for their preparation and their use as pharmaceuticals SLC5A2, CYP1B1, CYP2C19 ALDH1A1 259/4885MAPT 4316/4885KDM4E 2298/4885

“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.

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