SCHEMBL9624326

SCHEMBL9624326

CCCCCCCCCCc1cnc(-c2ccc(OC(=O)CC(CCCC)C(F)(F)F)cc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.54
MAPT P10636 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
RAB9A P51151 4/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 2/20 0.39
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
THRB P10828 3/20 0.39
THRA P10827 1/20 0.39
CASP3 P42574 1/20 0.38

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
SCHEMBL8435596 0.91 RARB (0.46) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL8436583 0.88 RARB (0.46) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL8434200 0.87 RARB (0.45) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL8433923 0.87 RARB (0.45) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL8432234 0.86 KMT2A (0.43) RARBMAPTSMN1; SMN2RAB9AMEN1
SCHEMBL8433914 0.86 RARB (0.46) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL8432006 0.86 RARB (0.46) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL10702141 0.84 RARB (0.55) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL9362083 0.84 RARB (0.55) RARBMAPTSMN1; SMN2RAB9AHSD17B10
SCHEMBL9351975 0.84 MAPT (0.56) RARBMAPTSMN1; SMN2RAB9AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0301511-B1 OPTICALLY ACTIVE COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING SAME CANON KABUSHIKI KAISHA (JP) 1992-01-22 EP disclosed
US-5073306-A Trifluoromethylalkyl substituted CANON KABUSHIKI KAISHA (JP) 1991-12-17 US disclosed
US-4918213-A HAVING A TRIFLUOROMETHYL GROUP ATTACHED TO ASYMMETRIC CARBON ATOM; STABLE; OPTICAL DEVICES CANON KABUSHIKI KAISHA (JP) 1990-04-17 US disclosed
EP-0301511-A1 Optically active compound and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1989-02-01 EP disclosed