SCHEMBL365481

SCHEMBL365481

O=C(O)c1ccc(C(Cl)(Cl)c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.54
DAO P14920 1/20 0.54
NAPRT Q6XQN6 1/20 0.54
TP53 P04637 1/20 0.52
SRD5A2 P31213 6/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
CYP1A2 P05177 1/20 0.50
ALOX15 P16050 1/20 0.48
TRPA1 O75762 1/20 0.47
KIF11 P52732 1/20 0.46
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA3 P07451 1/20 0.44
TYR P14679 1/20 0.44
DRD1 P21728 1/20 0.44
CA4 P22748 1/20 0.44

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
SCHEMBL3551983 0.93 TSHR (0.60) TSHRDAONAPRTTP53SRD5A2
SCHEMBL931931 0.87 TSHR (0.54) TSHRDAONAPRTTP53SRD5A2
SCHEMBL18896444 0.82 TSHR (0.59) TSHRDAONAPRTTP53SRD5A2
SCHEMBL20721895 0.82 TSHR (0.59) TSHRDAONAPRTTP53SRD5A2
SCHEMBL11670749 0.81 TSHR (0.61) TSHRCYP1A2ALOX15KIF11
Benzoic Acid SCHEMBL28194477 0.80 TSHR (0.64) TSHRDAONAPRTTP53SRD5A2
SCHEMBL407595 0.80 TSHR (0.56) TSHRDAONAPRTTP53SRD5A2
SCHEMBL5311010 0.80 TSHR (0.56) TSHRDAONAPRTTP53SRD5A2
SCHEMBL3370870 0.79 TSHR (0.60) TSHRDAONAPRTTP53SRD5A2
Benzoic Acid SCHEMBL11359136 0.79 TSHR (0.78) TSHRDAONAPRTTP53SRD5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9290586-B2 Solid catalyst component, catalyst comprising said solid component, and process for the (CO)polymerization of α-olefins VERSALIS S.P.A. (IT) 2016-03-22 US disclosed
US-20160060370-A1 SOLID CATALYST COMPONENT, CATALYST COMPRISING SAID SOLID COMPONENT, AND PROCESS FOR THE (CO)POLYMERIZATION OF ALPHA-OLEFINS VERSALIS S.P.A. (IT) 2016-03-03 US disclosed
US-20130303360-A1 SOLID CATALYST COMPONENT, CATALYST COMPRISING SAID SOLID COMPONENT, AND PROCESS FOR THE (CO)POLYMERIZATION OF ALPHA-OLEFINS VERSALIS S.P.A. (IT) 2013-11-14 US disclosed
EP-2593427-A1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN Pfizer Limited (GB) 2013-05-22 EP disclosed
WO-2012007883-A1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LIMITED (GB) 2012-01-19 WO disclosed