SCHEMBL7933386

SCHEMBL7933386

CCOC(=O)C(C=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
MAPT P10636 3/20 0.43
ALDH1A1 P00352 1/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL7939864 0.86 ALOX15 (0.41) CYP3A4CYP2C9MAPTALDH1A1MEN1
SCHEMBL29019506 0.83 CYP3A4 (0.43) CYP3A4CYP2C9MAPTALDH1A1MEN1
SCHEMBL1432899 0.81 CYP3A4 (0.47) CYP3A4CYP2C9MAPTALDH1A1MEN1
SCHEMBL11022536 0.80 CYP3A4 (0.46) CYP3A4CYP2C9MAPTALDH1A1MEN1
SCHEMBL9365929 0.79 CYP3A4 (0.45) CYP3A4CYP2C9MAPTALDH1A1MEN1
SCHEMBL3232287 0.78 CA12 (0.45) CYP3A4MAPTALDH1A1LMNAHTT
SCHEMBL8027004 0.78 CYP3A4 (0.47) CYP3A4CYP2C9MAPTALDH1A1MEN1
SCHEMBL11856131 0.77 CYP3A4 (0.50) CYP3A4CYP2C9MAPTALDH1A1LMNA
SCHEMBL6368506 0.77 MAPT (0.44) CYP3A4MAPTALDH1A1MEN1KMT2A
SCHEMBL4374262 0.75 MAPT (0.43) CYP3A4CYP2C9MAPTALDH1A1MEN1

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
US-6242634-B1 OF HERBICIDES, HALOPHENYL COMPOUNDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-05 US disclosed
US-6100257-A 2-HALOALKYL,3-(HALOALKYL, ALKENYL, OR ALKYNYL),5-(SUBSTITUTED PHENYL OR HETEROCYCLE),6-ALKYL-PYRIMIDIN-4-ONE COMPOUNDS OF GIVEN STRUCTURE; USE AS HERBICIDES SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2000-08-08 US disclosed
EP-0850229-A1 PYRIMIDIN-4-ONE DERIVATIVES, THEIR USE AS HERBICIDES, INTERMEDIATES FOR THEIR PRODUCTION AND PROCESSES FOR PRODUCING THESE COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-07-01 EP disclosed
WO-1997006150-A1 PYRIMIDIN-4-ONE DERIVATIVES, THEIR USE AS HERBICIDES, INTERMEDIATES FOR THEIR PRODUCTION AND PROCESSES FOR PRODUCING THESE COMPOUNDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-02-20 WO disclosed