SCHEMBL10554223

SCHEMBL10554223

CCCCc1ccc(CCc2ccc(-c3ccc(CCCC)cc3)nc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.79
SMN1; SMN2 Q16637 12/20 0.79
NPC1 O15118 10/20 0.79
NFKB1 P19838 5/20 0.79
NFKB2 Q00653 4/20 0.79
RELA Q04206 4/20 0.79
L3MBTL1 Q9Y468 3/20 0.79
MAPK1 P28482 2/20 0.79
MAPT P10636 6/20 0.69
STAT3 P40763 1/20 0.69
ATM Q13315 1/20 0.69
CASP3 P42574 2/20 0.68
SENP8 Q96LD8 2/20 0.68
SENP7 Q9BQF6 2/20 0.68
SENP6 Q9GZR1 2/20 0.68
KDM4E B2RXH2 5/20 0.57
ALDH1A1 P00352 5/20 0.57
HPGD P15428 4/20 0.57
TP53 P04637 3/20 0.56
POLB P06746 1/20 0.54

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
SCHEMBL10554271 1.00 RAB9A (0.79) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL9620816 0.98 RAB9A (0.81) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10554902 0.97 RAB9A (0.75) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10556794 0.97 RAB9A (0.75) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10554655 0.97 SMN1; SMN2 (0.74) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10558591 0.97 SMN1; SMN2 (0.74) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10558522 0.97 SMN1; SMN2 (0.74) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10554519 0.97 RAB9A (0.75) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10557449 0.97 RAB9A (0.75) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10561388 0.97 SMN1; SMN2 (0.74) RAB9ASMN1; SMN2NPC1NFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4879060-A 2-phenylpyridine derivatives and liquid crystal compositions including same SEIKO EPSON KABUSHIKI KAISHA (JP) 1989-11-07 US disclosed
US-4684220-A 2-phenylpyridine derivatives and liquid crystal compositions including same SEIKO EPSON KABUSHIKI KAISHA (JP) 1987-08-04 US disclosed