SCHEMBL14528958

SCHEMBL14528958

Cc1ccn2cc(-c3ccc(O)cc3F)nc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.54
TP53 P04637 1/20 0.54
HRH3 Q9Y5N1 3/20 0.53
RAB9A P51151 10/20 0.53
NPC1 O15118 9/20 0.53
KDM4E B2RXH2 9/20 0.53
ALDH1A1 P00352 7/20 0.53
POLB P06746 4/20 0.53
GAA P10253 2/20 0.53
GFER P55789 1/20 0.53
KMT2A Q03164 1/20 0.53
HPGD P15428 1/20 0.53
MAPT P10636 3/20 0.48
SUV39H2 Q9H5I1 2/20 0.48
PKM P14618 2/20 0.48
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL5263773 0.76 HRH3 (0.73) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL15932391 0.75 RAB9A (0.56) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL30874707 0.74 SMN1; SMN2 (0.59) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL19174232 0.73 SMN1; SMN2 (0.70) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL13325910 0.73 SMN1; SMN2 (0.93) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL4727102 0.73 SMN1; SMN2 (0.79) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL23754485 0.72 NPC1 (0.63) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL1691516 0.72 RAB9A (0.60) SMN1; SMN2TP53HRH3RAB9ANPC1
SCHEMBL28437603 0.71 SMN1; SMN2 (0.51) SMN1; SMN2TP53RAB9ANPC1KDM4E
SCHEMBL1691344 0.70 RAB9A (0.72) SMN1; SMN2TP53RAB9ANPC1KDM4E

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-1268478-B1 PHENYL-SUBSTITUTED IMIDAZOPYRIDINES ORTHO MCNEIL PHARM INC (US) 2007-05-02 EP disclosed