SCHEMBL10557313

SCHEMBL10557313

CCCCCc1ccc(-c2ccc(C(C)=O)cn2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.71
▸ SMN1; SMN2 Q16637 7/20 0.71
▸ NPC1 O15118 7/20 0.71
▸ NFKB1 P19838 2/20 0.71
▸ NFKB2 Q00653 2/20 0.71
▸ RELA Q04206 2/20 0.71
▸ MAPT P10636 4/20 0.60
▸ STAT3 P40763 1/20 0.60
▸ ATM Q13315 1/20 0.60
▸ ALDH1A1 P00352 3/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ HPGD P15428 2/20 0.57
▸ CASP3 P42574 2/20 0.57
▸ SENP8 Q96LD8 2/20 0.57
▸ SENP7 Q9BQF6 2/20 0.57
▸ SENP6 Q9GZR1 2/20 0.57
▸ TP53 P04637 1/20 0.57
▸ RARB P10826 6/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ MEN1 O00255 1/20 0.55

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
SCHEMBL30175860 0.96 RAB9A (0.65) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10348208 0.90 RAB9A (0.78) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL18573222 0.88 RAB9A (0.70) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL9734731 0.88 SMN1; SMN2 (0.82) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL1758363 0.83 RAB9A (0.64) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL9805357 0.83 RAB9A (1.00) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL8595854 0.83 SMN1; SMN2 (0.83) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL10662853 0.82 RAB9A (0.97) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL9723816 0.82 RAB9A (0.97) RAB9ASMN1; SMN2NPC1NFKB1NFKB2
SCHEMBL9075010 0.82 RARB (0.75) MAPTALDH1A1RARBMEN1RARA

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
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