SCHEMBL7699798

SCHEMBL7699798

CSc1cccc(NC(=O)c2nc(-c3ccccc3)oc2-c2ccc(NC(C)=O)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.59
KDM4E B2RXH2 2/20 0.59
SMN1; SMN2 Q16637 5/20 0.53
ALDH1A1 P00352 3/20 0.53
NPC1 O15118 6/20 0.49
RAB9A P51151 6/20 0.49
POLB P06746 3/20 0.49
CASP3 P42574 1/20 0.49
SENP8 Q96LD8 1/20 0.49
SENP7 Q9BQF6 1/20 0.49
SENP6 Q9GZR1 1/20 0.49
TSHR P16473 1/20 0.49
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
MAPK10 P53779 1/20 0.48
GRM4 Q14833 1/20 0.48
MAPT P10636 4/20 0.48
TP53 P04637 2/20 0.48
HSD17B10 Q99714 2/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL7693822 0.91 NR1H4 (0.48) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7703233 0.89 KDM4E (0.73) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7694095 0.87 SMN1; SMN2 (0.49) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7694070 0.86 KDM4E (0.73) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7703322 0.83 KDM4E (0.72) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7701004 0.83 KDM4E (0.59) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7699503 0.82 ALDH1A1 (0.56) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7698000 0.81 KDM4E (0.65) GAAKDM4ESMN1; SMN2ALDH1A1NPC1
SCHEMBL7694233 0.81 SMN1; SMN2 (0.44) GAASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL7699812 0.81 MEN1 (0.56) GAAKDM4ESMN1; SMN2ALDH1A1NPC1

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
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed