SCHEMBL8501257

SCHEMBL8501257

Cc1ccc(C)c([Sn](C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.44
ALDH1A1 P00352 2/20 0.44
CYP1A2 P05177 4/20 0.39
CYP2A6 P11509 4/20 0.39
TP53 P04637 2/20 0.39
TAAR1 Q96RJ0 1/20 0.37
HSD17B10 Q99714 2/20 0.35
GAA P10253 2/20 0.35
RAPGEF4 Q8WZA2 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
ACHE P22303 2/20 0.35
CYP3A4 P08684 2/20 0.35
THRB P10828 1/20 0.35
ALOX15 P16050 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TRPA1 O75762 1/20 0.35
ADRA2A P08913 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL1028129 0.81 TDP1 (0.46) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL8502547 0.79 TDP1 (0.44) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL1031939 0.77 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL1030327 0.77 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL1031216 0.77 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL1030428 0.77 TDP1 (0.42) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL15529813 0.73 TDP1 (0.39) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL15529745 0.73 TDP1 (0.39) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL15529622 0.73 TDP1 (0.39) TDP1ALDH1A1CYP1A2CYP2A6TP53
SCHEMBL15529912 0.72 CYP2A6 (0.38) TDP1ALDH1A1CYP1A2CYP2A6TP53

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-RE36256-E ADMINISTERING ARYL-SUBSTITUTED QUINOXALINE DERIVATIVES AS ANTIPROLIFERATIVE, ANTICARCINOGENIC AND ANTITUMOR AGENTS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-07-20 US disclosed
US-5795889-A INHIBITING CELL GROWTH WITH ENZYME INHIBITORS FOR SKIN DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-08-18 US disclosed
US-5656643-A QUINOLIN PYRIDINE DERIVATIVES; USEFUL FOR TREATING CANCER, LEKEMIA, PSORIASIS, INFLAMMATORY DISODERS, BONE DISORDERS, ATHEROSCLEROSIS AND RESTENOSIS; CONTROLLS CELLULAR REPRODUCTION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-08-12 US disclosed
US-5646153-A INHIBITING ABNORMAL CELL PROLIFERATION RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-08 US disclosed
US-5480883-A Bis mono- and bicyclic aryl and heteroaryl compounds which inhibit EGF and/or PDGF receptor tyrosine kinase RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-01-02 US disclosed
US-5409930-A Inhibits abnoramal cell proliferation; dimethoxyquinoline/ dimethylquinoline/ quinolineoxide/ and quinoxaline derivatives RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-04-25 US disclosed
WO-1992020642-A1 BIS MONO-AND BICYCLIC ARYL AND HETEROARYL COMPOUNDS WHICH INHIBIT EGF AND/OR PDGF RECEPTOR TYROSINE KINASE RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-11-26 WO disclosed
US-4316853-A Insecticidal tetraorganotin compounds M&T CHEMICALS INC. (US) 1982-02-23 US disclosed
EP-0001717-B1 INSECTICIDAL COMPOSITIONS CONTAINING TETRAORGANOTIN COMPOUNDS AND METHOD FOR USING SAME M & T CHEMICALS, INC. (US) 1981-11-04 EP disclosed
EP-0001716-B1 TETRA-ORGANOTIN COMPOUNDS IN WHICH THE TIN IS BONDED TO THREE METHYL GROUPS AND IS BONDED DIRECTLY OR THROUGH A METHYLENE GROUP TO A BENZENE RING OR HETEROCYCLIC RADICAL M & T CHEMICALS, INC. (US) 1981-09-16 EP disclosed
US-4212810-A INSECTICIDES M&T CHEMICALS INC. (US) 1980-07-15 US disclosed
US-4212885-A Insecticidal compositions containing certain tetraorganotin compounds and method for using same M&T CHEMICALS INC. (US) 1980-07-15 US disclosed
EP-0001717-A2 Insecticidal compositions containing tetraorganotin compounds and method for using same M & T CHEMICALS, INC. (US) 1979-05-02 EP disclosed