SCHEMBL9868637

SCHEMBL9868637

Clc1ccc(-c2nc3ncc(Cl)cc3o2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.45
ALDH1A1 P00352 5/20 0.45
HPGD P15428 5/20 0.45
KDM4E B2RXH2 5/20 0.45
LMNA P02545 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
CASP3 P42574 2/20 0.44
SENP7 Q9BQF6 2/20 0.44
SENP6 Q9GZR1 2/20 0.44
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
MAOA P21397 1/20 0.43
ADRA1A P35348 1/20 0.43
MEN1 O00255 1/20 0.41
ADRB2 P07550 1/20 0.41
KMT2A Q03164 1/20 0.41
CHRNA7 P36544 1/20 0.41
HTR3A P46098 1/20 0.41

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
SCHEMBL9866308 0.85 CETP (0.43) SMN1; SMN2ALDH1A1HPGDKDM4ELMNA
SCHEMBL9868913 0.85 NPC1 (0.46) SMN1; SMN2ALDH1A1HPGDKDM4ELMNA
SCHEMBL22259813 0.80 MAPT (0.42) MAOAADRA1AMAPTRXFP1TP53
SCHEMBL31631303 0.79 NPC1 (0.64) SMN1; SMN2ALDH1A1HPGDKDM4ENFKB1
SCHEMBL27075892 0.78 CHRNA7 (0.47) SMN1; SMN2ALDH1A1HPGDNPC1RAB9A
SCHEMBL30648212 0.78 CHRNA7 (0.47) SMN1; SMN2ALDH1A1HPGDNPC1RAB9A
SCHEMBL9868181 0.77 NPC1 (0.71) SMN1; SMN2ALDH1A1HPGDKDM4ENPC1
SCHEMBL9867554 0.76 NPC1 (0.50) SMN1; SMN2ALDH1A1HPGDKDM4ENFKB1
SCHEMBL9374831 0.76 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1HPGDKDM4ELMNA
SCHEMBL9374824 0.75 KDM4E (0.44) SMN1; SMN2ALDH1A1HPGDKDM4ELMNA

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
US-5077408-A PROCESS FOR THE SYNTHESIS OF OXAZOLOPYRIDINE COMPOUNDS SCIENCE ET ORGANISATION (FR) 1991-12-31 US disclosed