SCHEMBL9150204

SCHEMBL9150204

CCCCCCCCCCCC(=O)Oc1ccc(-c2ccc(OC[C@@H](C)CC)c(Cl)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.44
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TOP2A P11388 2/20 0.41
MAPK1 P28482 1/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HPGD P15428 1/20 0.39
RET P07949 1/20 0.38
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
PTPN11 Q06124 1/20 0.38
TRPV3 Q8NET8 1/20 0.38
XDH P47989 1/20 0.37

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
SCHEMBL9146036 1.00 ALOX15 (0.44) ALOX15MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL9148886 1.00 ALOX15 (0.44) ALOX15MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL9149162 0.91 PPARG (0.45) ALOX15MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL9145224 0.91 PPARG (0.45) ALOX15MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL9145944 0.91 PPARG (0.45) ALOX15MAPTKMT2ASMN1; SMN2ALDH1A1
SCHEMBL9145910 0.87 ALOX15 (0.44) ALOX15KMT2ASMN1; SMN2TOP2ATHRA
SCHEMBL9149139 0.87 ALOX15 (0.44) ALOX15KMT2ASMN1; SMN2TOP2ATHRA
SCHEMBL9148654 0.83 MAPT (0.48) ALOX15MAPTKMT2ASMN1; SMN2TOP2A
SCHEMBL10613445 0.82 PTPN11 (0.41) ALOX15MAPTKMT2ASMN1; SMN2TOP2A
SCHEMBL9148575 0.82 SMN1; SMN2 (0.42) MAPTKMT2ASMN1; SMN2MAPK1THRA

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-5397504-A Liquid crystal KANTO KAGAKU KABUSHIKI KAISHA (JP) 1995-03-14 US disclosed
EP-0315701-B1 BIPHENYL COMPOUND KANTO KAGAKU (JP) 1993-12-29 EP disclosed
EP-0315701-A1 BIPHENYL COMPOUND KANTO KAGAKU KABUSHIKI KAISHA (JP) 1989-05-17 EP disclosed