SCHEMBL15599249

SCHEMBL15599249

CCc1cc(C)c(C#N)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.46
LMNA P02545 2/20 0.46
CYP2A6 P11509 1/20 0.43
USP2 O75604 1/20 0.43
ALDH1A1 P00352 4/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
ALOX15 P16050 2/20 0.41
APOBEC3G Q9HC16 2/20 0.41
MAPT P10636 1/20 0.41
HAVCR2 Q8TDQ0 1/20 0.41
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
RECQL P46063 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
UPP1 Q16831 1/20 0.38
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL3004075 0.83 MEN1 (0.44) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL27878369 0.82 KDM4E (0.44) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL28248982 0.79 KDM4E (0.40) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL5524083 0.79 KDM4E (0.40) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL25786462 0.79 KDM4E (0.40) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL28650262 0.79 KDM4E (0.42) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL24854679 0.77 KDM4E (0.43) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL28068652 0.76 CYP2A6 (0.43) KDM4ELMNACYP2A6USP2ALDH1A1
SCHEMBL28865511 0.76 KDM4E (0.40) KDM4ELMNAUSP2ALDH1A1HPGD
SCHEMBL27878373 0.76 CYP2A6 (0.39) KDM4ELMNACYP2A6USP2ALDH1A1

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
CN-106083927-B Phosphino- amidine compound, metal complex, antigravity system and their oligomeric or olefin polymerization purposes 切弗朗菲利浦化学公司 2018-10-26 CN disclosed
CN-106083927-A Phosphinyl amidine compound, metal complex, antigravity system and their oligomeric or purposes of olefin polymerization 切弗朗菲利浦化学公司 2016-11-09 CN disclosed
CN-102781949-B Phosphinyl amidine compounds, metal complexes, catalyst systems, and their use for oligomerizing or polymerizing olefins 切弗朗菲利浦化学公司 2016-07-06 CN disclosed
WO-2014144545-A2 SUBSTITUTED BENZOXAZOLES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2014-09-18 WO disclosed
WO-2014008458-A2 N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2014-01-09 WO disclosed
CN-102781949-A Phosphinyl amidine compounds, metal complexes, catalyst systems, and their use for oligomerizing or polymerizing olefins CHEVRON PHILLIPS CHEMICAL CO 2012-11-14 CN disclosed