SCHEMBL8942445

SCHEMBL8942445

CCCCOP(=S)(Cl)OCC

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.44
LPAR3 Q9UBY5 9/20 0.43
LPAR2 Q9HBW0 7/20 0.43
TDP1 Q9NUW8 2/20 0.37
TP53 P04637 1/20 0.37
LPAR1 Q92633 3/20 0.36
TSHR P16473 1/20 0.34
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL2150345 0.93 CYP3A4 (0.50) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL8058942 0.86 TDP1 (0.40) CYP3A4LPAR3LPAR2TDP1TP53
SCHEMBL5852225 0.86 LPAR3 (0.58) CYP3A4LPAR3LPAR2LPAR1
SCHEMBL2150299 0.84 LPAR3 (0.61) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL5852206 0.84 LPAR3 (0.61) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL8044300 0.84 LPAR3 (0.61) CYP3A4LPAR3LPAR2LPAR1TSHR
SCHEMBL1149901 0.83
SCHEMBL11422055 0.78
SCHEMBL2150777 0.78 LPAR2 (0.36) CYP3A4LPAR3LPAR2TDP1TP53
SCHEMBL1604996 0.76 MEN1 (0.54) CYP3A4LPAR3LPAR2TDP1LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5536711-A Bisphosphoryl hydrazines and their use as pesticides ROHM AND HAAS COMPANY (US) 1996-07-16 US disclosed
US-5536710-A Bisphosphoryl hydrazines and their use as pesticides ROHM AND HAAS COMPANY (US) 1996-07-16 US disclosed
US-5536712-A Bisphosphoryl hydrazines and their use as pesticides ROHM AND HAAS COMPANY (US) 1996-07-16 US disclosed
EP-0437336-B1 Biophosphoryl hydrazines and their use as pesticides ROHM & HAAS (US) 1996-02-28 EP disclosed
US-5461038-A Bisphosphoryl hydrazines and their use as pesticides ROHM AND HAAS COMPANY (US) 1995-10-24 US disclosed
EP-0437335-A1 Dithiopyrophosphates and their use as pesticides ROHM AND HAAS COMPANY (US) 1991-07-17 EP disclosed
EP-0437336-A1 Biophosphoryl hydrazines and their use as pesticides ROHM AND HAAS COMPANY (US) 1991-07-17 EP disclosed
US-4474776-A Anthryl substituted phosphorus compounds as insecticides VELSICOL CHEMICAL CORPORATION (US) 1984-10-02 US disclosed
US-4474774-A Acridone substituted phosphorus compounds, compositions containing same and insecticidal method of use VELSICOL CHEMICAL CORPORATION (US) 1984-10-02 US disclosed
US-4452792-A Acridine substituted phosphorus compounds and their insecticidal use VELSICOL CHEMICAL CORPORATION (US) 1984-06-05 US disclosed
US-4447420-A Fluorenone esters of phosphoric and phosphonic acids as insecticides VELSICOL CHEMICAL CORPORATION (US) 1984-05-08 US disclosed
US-4404220-A INSECTIDES VELSICOL CHEMICAL CORPORATION (US) 1983-09-13 US disclosed
US-4299772-A INSECTICIDES VELSICOL CHEMICAL CORPORATION (US) 1981-11-10 US disclosed