SCHEMBL9357676

SCHEMBL9357676

CCCCCCCCCCOc1cnc(-c2ccc(-c3ccc(OC(=O)O[C@H](C)CCCCCC)cc3)cc2)nc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 5/20 0.48
▸ NPC1 O15118 8/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ LMNA P02545 4/20 0.45
▸ NFKB1 P19838 3/20 0.45
▸ NFKB2 Q00653 3/20 0.45
▸ RELA Q04206 3/20 0.45
▸ RAB9A P51151 5/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ ACACB O00763 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ TP53 P04637 1/20 0.42

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
SCHEMBL10701525 1.00 RARB (0.48) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10702467 0.88 RARB (0.56) RARBNPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL9357130 0.88 RARB (0.56) RARBNPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL9791263 0.87 LMNA (0.54) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL10701910 0.86 RARB (0.47) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL9357394 0.86 RARB (0.50) RARBNPC1SMN1; SMN2NFKB1NFKB2
SCHEMBL9357499 0.86 RARB (0.47) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL14802207 0.85 RARB (0.52) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL9624367 0.85 RARB (0.48) RARBNPC1SMN1; SMN2LMNANFKB1
SCHEMBL9357102 0.84 RARB (0.53) RARBNPC1SMN1; SMN2LMNANFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0289270-B1 Optically active 2-biphenylpyrimidine derivatives and liquid crystal compositions containing them CHISSO CORP (JP) 1994-12-14 — — EP disclosed
US-5059340-A For display mode CHISSO CORPORATION (JP) 1991-10-22 — — US disclosed
EP-0289270-A1 Optically active 2-biphenylpyrimidine derivatives and liquid crystal compositions containing them Chisso Corporation (JP) 1988-11-02 — — EP disclosed
Send feedback