SCHEMBL8998766

SCHEMBL8998766

C=CCCCC(C)=CCO

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.52
CYP3A4 P08684 3/20 0.52
MEN1 O00255 2/20 0.52
ALOX15 P16050 2/20 0.52
MAPT P10636 4/20 0.50
ALDH1A1 P00352 3/20 0.50
UGT1A1 P22309 1/20 0.50
PTPN1 P18031 1/20 0.46
SQLE Q14534 5/20 0.41
TSHR P16473 3/20 0.39
LSS P48449 1/20 0.37
ABCC4 O15439 1/20 0.35
LMNA P02545 2/20 0.35
CNR1 P21554 1/20 0.33
USP2 O75604 1/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL8998761 1.00 KMT2A (0.52) KMT2ACYP3A4MEN1ALOX15MAPT
SCHEMBL8998543 0.93 CYP3A4 (0.50) KMT2ACYP3A4MEN1ALOX15MAPT
SCHEMBL8998539 0.93 CYP3A4 (0.50) KMT2ACYP3A4MEN1ALOX15MAPT
SCHEMBL8998674 0.91 CYP3A4 (0.48) KMT2ACYP3A4MEN1ALOX15MAPT
SCHEMBL8998691 0.91 CYP3A4 (0.48) KMT2ACYP3A4MEN1ALOX15MAPT
SCHEMBL15431138 0.86
SCHEMBL8998607 0.86
SCHEMBL8998599 0.86
SCHEMBL846892 0.82 ALDH1A1 (0.44) KMT2ACYP3A4MEN1ALOX15MAPT
SCHEMBL846891 0.82 ALDH1A1 (0.44) KMT2ACYP3A4MEN1ALOX15MAPT

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-0258967-B2 Process for producing optically active alcohols TAKASAGO PERFUMERY CO LTD (JP) 1996-08-21 EP disclosed
EP-0410244-A1 Leukotriene antagonists BAYER AG (DE) 1991-01-30 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