SCHEMBL3194657

SCHEMBL3194657

Cc1cccc(C)c1[S+](c1ccccc1)c1ccccc1.O=S(=O)([O-])c1c(C(F)(F)F)cc(C(F)(F)F)cc1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2C19 P33261 2/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
FFAR1 O14842 1/20 0.34
CDK1 P06493 1/20 0.34
CCNB1 P14635 1/20 0.34
CCNA2 P20248 1/20 0.34
CDK2 P24941 1/20 0.34
CDK7 P50613 1/20 0.34
CCNH P51946 1/20 0.34
CCNA1 P78396 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
MCL1 Q07820 1/20 0.34
KDM4E B2RXH2 3/20 0.34

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
SCHEMBL3201678 0.92 CYP1A2 (0.41) CYP1A2CYP3A4CYP2C19MAPTMAPK1
SCHEMBL3202327 0.87 MCL1 (0.40) CYP1A2CYP3A4CYP2C19MAPTMAPK1
SCHEMBL3183550 0.86 KDM4E (0.32) CYP1A2CYP3A4CYP2C19MAPTMEN1
SCHEMBL3204874 0.84 MEN1 (0.37) CYP1A2CYP3A4CYP2C19MAPTMAPK1
SCHEMBL3203647 0.83 HSD11B1 (0.39) MAPTMEN1KMT2ATSHRFFAR1
SCHEMBL3183476 0.83 SLC22A12 (0.31) CYP1A2CYP3A4CYP2C19MAPTAVPR2
SCHEMBL3201110 0.82 CYP1A2 (0.39) CYP1A2CYP3A4CYP2C19MAPTMAPK1
SCHEMBL3193023 0.82 CYP1A2 (0.31) CYP1A2CYP3A4CYP2C19MAPTMAPK1
SCHEMBL3197933 0.81 POLQ (0.34) FFAR4AVPR2GPR27POLQ
SCHEMBL4778703 0.81 FABP3 (0.33) AVPR2GPR27

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
US-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed
US-20100028800-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2010-02-04 US disclosed
EP-1953593-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2008-08-06 EP disclosed
US-7060414-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-06-13 US disclosed
US-20050158657-A1 Radiation-sensitive resin composition SUZUKI AKI (JP) 2005-07-21 US disclosed
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US disclosed