SCHEMBL9226506

SCHEMBL9226506

O=C(NCc1ccccc1C(=O)O)Nc1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 2/20 0.72
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
MAPT P10636 1/20 0.63
RAB9A P51151 9/20 0.56
NPC1 O15118 8/20 0.56
KCNA5 P22460 1/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
TP53 P04637 2/20 0.54
POLB P06746 1/20 0.54
MAOB P27338 1/20 0.54
CFD P00746 1/20 0.54
HTT P42858 1/20 0.54
HPGD P15428 1/20 0.54
EPHX1 P07099 1/20 0.52
TSHR P16473 1/20 0.52
EPHX2 P34913 1/20 0.52
CDK9 P50750 1/20 0.52
CLK4 Q9HAZ1 1/20 0.52
ALDH1A1 P00352 2/20 0.51

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
SCHEMBL4242287 0.88 KCNA5 (0.66) HIF1AMEN1KMT2AMAPTRAB9A
SCHEMBL27953140 0.81 NPC1 (0.77) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL28559896 0.80 KMT2A (0.63) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL6141162 0.80 HTT (0.53) HIF1AKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL25148983 0.79 CYP2C9 (0.65) HIF1AMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL14830351 0.79 HIF1A (0.81) HIF1ARAB9ASMN1; SMN2HTTTSHR
SCHEMBL28912557 0.78 MEN1 (1.00) MEN1KMT2AMAPTRAB9ANPC1
SCHEMBL2652549 0.77 HTT (0.53) HIF1AKMT2APOLBCFDHTT
SCHEMBL9848860 0.77 HTT (0.57) HIF1AKMT2AHTTHPGDTSHR
SCHEMBL12700344 0.77 HTT (0.76) HIF1AKMT2AMAPTHTTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0667342-A1 Substituted Arylureas and their use as anti-atheriosclerotic compounds BAYER AG (DE) 1995-08-16 EP disclosed