SCHEMBL8775765

SCHEMBL8775765

COc1cccc(NC(=O)N(O)Cc2cccc(OC(c3ccccc3)c3cccnc3)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TSHR P16473 1/20 0.48
THRB P10828 1/20 0.47
USP2 O75604 1/20 0.45
ALDH1A1 P00352 3/20 0.45
NPSR1 Q6W5P4 2/20 0.44
RAB9A P51151 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPK1 P28482 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GAA P10253 3/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
CASR P41180 1/20 0.43

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
SCHEMBL8775912 0.81 CA12 (0.41) SMN1; SMN2LMNAHTT
SCHEMBL8776039 0.79 CASR (0.53) SMN1; SMN2TSHRTHRBUSP2ALDH1A1
SCHEMBL8775952 0.79 ALDH1A1 (0.44) SMN1; SMN2TSHRALDH1A1LMNA
SCHEMBL8775982 0.78 CASR (0.51) SMN1; SMN2TSHRTHRBALDH1A1KDM4E
SCHEMBL8775947 0.75 MAPK1 (0.47) SMN1; SMN2MAPK1LMNAMAPTHTT
SCHEMBL8775896 0.71 ALDH1A1 (0.54) SMN1; SMN2TSHRUSP2ALDH1A1NPSR1
SCHEMBL8775901 0.71 ALDH1A1 (0.47) SMN1; SMN2TSHRALDH1A1RAB9AHTT
SCHEMBL8775797 0.70 MMP1 (0.45) SMN1; SMN2TSHRALDH1A1GAALMNA
SCHEMBL11146506 0.70 ALDH1A1 (0.66) USP2ALDH1A1NPSR1RAB9ACASR
SCHEMBL6567020 0.69 KDM4E (0.51) SMN1; SMN2TSHRALDH1A1NPSR1KDM4E

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-0807626-A1 N-HYDROXYUREA DERIVATIVES Nikken Chemicals Company, Limited (JP) 1997-11-19 EP disclosed