SCHEMBL7791058

SCHEMBL7791058

CCCCCCC(F)COc1ccc(-c2cnc(-c3ccc(OC(=O)C(C)CCCCCC)c(F)c3)nc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 8/20 0.37
▸ RARB P10826 6/20 0.35
▸ RARA P10276 1/20 0.35
▸ SMPD1 P17405 1/20 0.34
▸ PLA2G4B P0C869 1/20 0.33
▸ THRA P10827 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ NPC1 O15118 2/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32

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
SCHEMBL7791049 0.94 THRA (0.34) FAAHRARBSMPD1THRATHRB
SCHEMBL7793990 0.90 AAK1 (0.35) FAAHRARBRARATHRATHRB
SCHEMBL7091583 0.85 RARB (0.47) FAAHRARBRARASMPD1NPC1
SCHEMBL7794964 0.85 RARB (0.40) RARBSMPD1PLA2G4BNPC1RAB9A
SCHEMBL7795424 0.82 RARB (0.39) RARBSMPD1PLA2G4BNPC1RAB9A
SCHEMBL7795403 0.82 CYP3A4 (0.35) FAAHRARBTHRATHRB
SCHEMBL7791045 0.82 PTPN11 (0.47) RARBRARAPLA2G4BTHRATHRB
SCHEMBL7088460 0.81 RARB (0.44) FAAHRARBRARASMPD1NPC1
SCHEMBL8840890 0.81 THRA (0.38) FAAHRARBTHRATHRBPTPN11
SCHEMBL7092568 0.81 RARB (0.51) RARBRARATHRATHRBPTPN11

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-0821050-B1 Optically active compound and antiferroelectric liquid crystal composition containing the same SEMICONDUCTOR ENERGY LAB (JP) 2001-11-28 — — EP disclosed
US-5820782-A LOW THRESHOLD VOLTAGE AND LOW VISCOSITY; PYRIMIDINE-BASED COMPOUND TAKASAGO INTERNATIONAL CORPORATION (JP) 1998-10-13 — — US disclosed
EP-0821050-A1 Optically active compound and antiferroelectric liquid crystal composition containing the same Takasago International Corporation (JP) 1998-01-28 — — EP disclosed
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