SCHEMBL11277462

SCHEMBL11277462

Cc1nnc(C=O)n1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 1/20 0.51
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 3/20 0.41
HTT P42858 3/20 0.41
TSHR P16473 2/20 0.41
MAPK1 P28482 1/20 0.41
P2RX7 Q99572 1/20 0.41
OXTR P30559 1/20 0.40
KDM4C Q9H3R0 1/20 0.39
GSK3A P49840 1/20 0.38
GSK3B P49841 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
SCHEMBL3421771 0.80 AVPR1A (0.67) AVPR1AKMT2AMEN1KDM4EALDH1A1
SCHEMBL27397737 0.77 VCP (0.40) KMT2AMEN1ALDH1A1TSHRP2RX7
SCHEMBL11274510 0.75 HCAR1 (0.44) KMT2AMEN1KDM4EALDH1A1MAPK1
SCHEMBL10189850 0.74 AVPR1A (0.51) AVPR1AKMT2AMEN1KDM4EALDH1A1
SCHEMBL27417384 0.73 KDM4C (0.38) AVPR1AKMT2AMEN1ALDH1A1HTT
SCHEMBL4886001 0.72 ALDH1A1 (0.56) AVPR1AKMT2AMEN1ALDH1A1HTT
SCHEMBL10189840 0.71 AVPR1A (0.56) AVPR1AKMT2AMEN1KDM4EALDH1A1
SCHEMBL19068734 0.71 AVPR1A (0.56) AVPR1AKMT2AMEN1KDM4EALDH1A1
SCHEMBL9299272 0.71 AVPR1A (0.56) AVPR1AKMT2AMEN1KDM4EALDH1A1
SCHEMBL1562739 0.71 AVPR1A (0.56) AVPR1AKMT2AMEN1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1092769-A Cyclic urea derivatives, the method that contains the pharmaceutical composition of these compounds and prepare them THOMAE GMBH DR K (DE) 1994-09-28 CN claimed
CN-1092769-A Cyclic urea derivatives, the method that contains the pharmaceutical composition of these compounds and prepare them THOMAE GMBH DR K (DE) 1994-09-28 CN disclosed
US-4338453-A Aminoalkyl-1,2,4-triazoles THE UPJOHN COMPANY (US) 1982-07-06 US disclosed