SCHEMBL10514458

SCHEMBL10514458

CCCCCCCC(=O)Oc1cnc(-c2ccc(OCCCCCC)cc2)nc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 3/20 0.56
▸ NPC1 O15118 7/20 0.55
▸ RAB9A P51151 4/20 0.55
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ NFKB1 P19838 3/20 0.53
▸ NFKB2 Q00653 3/20 0.53
▸ RELA Q04206 3/20 0.53
▸ MAPT P10636 3/20 0.53
▸ LMNA P02545 3/20 0.53
▸ POLB P06746 1/20 0.53
▸ TP53 P04637 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ PLA2G4B P0C869 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.51
▸ ESR1 P03372 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49

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
SCHEMBL10511582 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10513815 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10514034 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10514774 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10511620 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10510193 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10513073 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10513208 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10512258 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL10512234 1.00 RARB (0.56) RARBNPC1RAB9ASMN1; SMN2KDM4E

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-0319167-A1 2-Phenyl-5-alkanoyloxypyrimidines Chisso Corporation (JP) 1989-06-07 — — EP disclosed
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