SCHEMBL9626164

SCHEMBL9626164

CCCCCCCCCCCCc1cnc(-c2ccc(OCc3ccc(OCCC(CCCC)C(F)(F)F)cc3)cc2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 2/20 0.46
RAB9A P51151 7/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
MAPT P10636 5/20 0.46
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 3/20 0.46
HSD17B10 Q99714 2/20 0.46
MEN1 O00255 2/20 0.46
USP2 O75604 2/20 0.46
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
NPC1 O15118 5/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
STAT3 P40763 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL9625879 0.95 RARB (0.50) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL9624358 0.89 MEN1 (0.46) RARBRAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL10693812 0.87 RAB9A (0.58) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10693844 0.87 RAB9A (0.58) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10691158 0.87 RAB9A (0.58) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10691455 0.87 RAB9A (0.58) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10695948 0.86 RAB9A (0.57) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10693947 0.86 RAB9A (0.57) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10693526 0.86 RAB9A (0.57) RARBRAB9ASMN1; SMN2MAPTKDM4E
SCHEMBL10691265 0.86 RAB9A (0.57) RARBRAB9ASMN1; SMN2MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-1242543-A None JP disclosed
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
JP-H01242543-A LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION AND ELEMENT CONTAINING SAID COMPOUND CANON INC 1989-09-27 JP disclosed
EP-0301511-A1 Optically active compound and liquid crystal composition containing same CANON KABUSHIKI KAISHA (JP) 1989-02-01 EP disclosed