SCHEMBL7795406

SCHEMBL7795406

CCCCCCCCC(F)COc1ccc(-c2cnc(-c3ccc(C(=O)O[C@H](CCCCCC)C(F)(F)F)cc3)nc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 4/20 0.39
▸ PLA2G4B P0C869 2/20 0.37
▸ NPC1 O15118 6/20 0.36
▸ RAB9A P51151 5/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ MAPT P10636 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 2/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ TP53 P04637 1/20 0.34
▸ THRA P10827 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ PNLIP P16233 1/20 0.34

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
SCHEMBL7791047 1.00 RARB (0.39) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9191943 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9189406 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9193907 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9192412 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9191392 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9187241 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9187819 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL9187001 0.91 RARB (0.50) RARBPLA2G4BNPC1RAB9ASMN1; SMN2
SCHEMBL7795427 0.87 THRA (0.35) RARBTHRATHRB

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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