SCHEMBL8998620

SCHEMBL8998620

CC(C)=CC/C(C)=C/CO

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
ALOX15 P16050 3/20 0.56
MEN1 O00255 2/20 0.56
CYP3A4 P08684 2/20 0.56
ALDH1A1 P00352 3/20 0.54
MAPT P10636 2/20 0.54
UGT1A1 P22309 1/20 0.54
SQLE Q14534 5/20 0.36
PTPN1 P18031 1/20 0.34
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL8998626 1.00 KMT2A (0.56) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL8813968 0.77 KMT2A (0.55) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL115620 0.77
SCHEMBL8998615 0.77
SCHEMBL7923694 0.77
SCHEMBL11500849 0.77
SCHEMBL1304714 0.75
SCHEMBL1304713 0.75
SCHEMBL14759436 0.74 KMT2A (0.35) KMT2AALOX15MEN1CYP3A4ALDH1A1
SCHEMBL14759437 0.74 KMT2A (0.35) KMT2AALOX15MEN1CYP3A4ALDH1A1

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-0258967-B2 Process for producing optically active alcohols TAKASAGO PERFUMERY CO LTD (JP) 1996-08-21 EP disclosed
US-4962242-A HYDROGENATING OLEFINIC ALCOHOL USING AS CATALYST A RUTHENIUM-OPTICALLY ACTIVE PHOSPHINE COMPLEX TAKASAGO PERFUMERY CO., LTD. (JP) 1990-10-09 US disclosed
EP-0258967-A2 Process for producing optically active alcohols Takasago Perfumery Co., Ltd. (JP) 1988-03-09 EP disclosed