SCHEMBL10359263

SCHEMBL10359263

COC(=O)CCOc1ccc(C)cc1Cl

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.65
CYP2C19 P33261 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP3A4 P08684 2/20 0.56
PPARG P37231 1/20 0.54
KDM4E B2RXH2 1/20 0.53
L3MBTL1 Q9Y468 5/20 0.51
HPGD P15428 5/20 0.51
RAB9A P51151 3/20 0.51
CYP2C9 P11712 2/20 0.51
NPC1 O15118 2/20 0.51
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 1/20 0.51
USP2 O75604 1/20 0.51
POLB P06746 1/20 0.51
ALOX12 P18054 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ATM Q13315 1/20 0.51

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
SCHEMBL4655730 0.91 MAPT (0.59) MAPTCYP2C19CYP1A2CYP3A4KDM4E
SCHEMBL10359783 0.84 PPARG (0.67) MAPTCYP2C19CYP1A2CYP3A4PPARG
SCHEMBL21991843 0.84 TSHR (0.67) CYP1A2PPARGL3MBTL1HPGDRAB9A
SCHEMBL15445592 0.81 TSHR (0.71) MAPTCYP2C19CYP1A2CYP3A4PPARG
SCHEMBL11196941 0.80 KMT2A (0.59) MAPTCYP2C19CYP1A2CYP3A4L3MBTL1
SCHEMBL20230373 0.79 PPARG (0.68) MAPTCYP2C19CYP1A2CYP3A4PPARG
SCHEMBL21595828 0.79 KDM4E (0.56) MAPTCYP2C19CYP1A2CYP3A4PPARG
SCHEMBL19607315 0.79 L3MBTL1 (0.64) MAPTCYP2C19CYP1A2CYP3A4KDM4E
SCHEMBL12998521 0.79 MAPT (1.00) MAPTCYP2C19CYP1A2CYP3A4L3MBTL1
SCHEMBL9487034 0.79 KDM4E (0.66) MAPTCYP2C19CYP1A2CYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0161547-B1 OPTICALLY ACTIVE POLYMERS USED IN THE CHROMATOGRAPHICAL SEPARATION OF RACEMATES BASF Aktiengesellschaft (DE) 1990-10-31 EP disclosed
EP-0161547-A2 Optically active polymers used in the chromatographical separation of racemates BASF Aktiengesellschaft (DE) 1985-11-21 EP disclosed