SCHEMBL8882933

SCHEMBL8882933

CCCCCCOc1ccc(-c2cnc(-c3ccc(CCCCCC)cc3)s2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 4/20 0.47
▸ S1PR1 P21453 2/20 0.45
▸ S1PR3 Q99500 2/20 0.45
▸ PTPN11 Q06124 2/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ USP2 O75604 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ CASP1 P29466 1/20 0.40
▸ SLCO1B3 Q9NPD5 1/20 0.40
▸ SLCO1B1 Q9Y6L6 1/20 0.40
▸ RAB9A P51151 4/20 0.40
▸ MAPT P10636 3/20 0.40
▸ PLA2G4A P47712 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ CASP3 P42574 1/20 0.40

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
SCHEMBL8882714 0.93 RARB (0.46) RARBS1PR1S1PR3PTPN11MEN1
SCHEMBL8882450 0.85 RARB (0.46) RARBS1PR1S1PR3PLA2G4ARARA
SCHEMBL8885615 0.85 RARB (0.48) RARBMEN1USP2ALDH1A1KMT2A
SCHEMBL8769198 0.84 RAB9A (0.51) S1PR1S1PR3MEN1USP2ALDH1A1
SCHEMBL8884758 0.84 RAB9A (0.51) S1PR1S1PR3MEN1USP2ALDH1A1
SCHEMBL17445757 0.84 RARB (0.63) RARBS1PR1S1PR3PTPN11MEN1
SCHEMBL8885096 0.83 RAB9A (0.43) S1PR1S1PR3PTPN11MEN1USP2
SCHEMBL8885499 0.83 RAB9A (0.43) S1PR1S1PR3PTPN11MEN1USP2
SCHEMBL16187781 0.81 RARB (0.52) RARBS1PR1S1PR3PTPN11MEN1
SCHEMBL8984168 0.81 RARB (0.52) RARBS1PR1S1PR3PTPN11MEN1

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
US-5595685-A THIAZOLE DERIVATIVE CANON KABUSHIKI KAISHA (JP) 1997-01-21 — — US disclosed
EP-0439170-B1 Mesomorphic compound, liquid crystal composition containing same, liquid crystal device using same and display apparatus CANON KK (JP) 1995-04-19 — — EP disclosed
EP-0439170-A2 Mesomorphic compound, liquid crystal composition containing same, liquid crystal device using same and display apparatus CANON KABUSHIKI KAISHA (JP) 1991-07-31 — — EP disclosed
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