SCHEMBL3420549

SCHEMBL3420549

Cc1cc(Cc2cc(C)c(OC#N)c(C)c2)cc(C)c1OC#N.N#COc1ccc(Cc2ccc(OC#N)c(Cl)c2)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 6/20 0.37
CYP3A4 P08684 1/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
CA2 P00918 1/20 0.34
AR P10275 1/20 0.34
TUBB4A P04350 1/20 0.33
TUBB P07437 1/20 0.33
TUBA3C P0DPH7 1/20 0.33
TUBA1B P68363 1/20 0.33
TUBA4A P68366 1/20 0.33
TUBB4B P68371 1/20 0.33
TUBB3 Q13509 1/20 0.33
TUBB2A Q13885 1/20 0.33
TUBB8 Q3ZCM7 1/20 0.33
TUBA3E Q6PEY2 1/20 0.33
TUBA1A Q71U36 1/20 0.33
TUBA1C Q9BQE3 1/20 0.33
TUBB6 Q9BUF5 1/20 0.33
TUBB2B Q9BVA1 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
SCHEMBL30343455 0.86 CYP3A4 (0.44) CSNK2A1CYP3A4CA2SLC6A4SLC6A3
SCHEMBL829807 0.86 CYP3A4 (0.44) CSNK2A1CYP3A4CA2SLC6A4SLC6A3
SCHEMBL175692 0.81 SHBG (0.35) ESR1ESR2
SCHEMBL4213486 0.80 ESR1 (0.39) CYP3A4ESR1ESR2CA2TUBB4A
SCHEMBL727075 0.80 ESR1 (0.44) CYP3A4ESR1ESR2CA2TUBB4A
SCHEMBL30259656 0.80 ESR1 (0.44) CYP3A4ESR1ESR2CA2TUBB4A
SCHEMBL5935272 0.74 CYP3A4 (0.34) CYP3A4
SCHEMBL12585748 0.73 SHBG (0.31)
SCHEMBL8509777 0.73 ESR1 (0.38) CYP3A4ESR1ESR2CA2TUBB4A
SCHEMBL2893712 0.73 ESR1 (0.38) CYP3A4ESR1ESR2CA2TUBB4A

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
EP-2209156-A1 Composite membrane and method for making General Electric Company (US) 2010-07-21 EP disclosed
US-20100167100-A1 COMPOSITE MEMBRANE AND METHOD FOR MAKING GENERAL ELECTRIC COMPANY 2010-07-01 US disclosed
EP-2102311-A1 FLAME RETARDANT COMPOSITION AND METHOD GENERAL ELECTRIC COMPANY (US) 2009-09-23 EP disclosed
US-7495047-B2 Poly(arylene ether) composition, method, and article AT&T INTELLECTUAL PROPERTY, I, L.P. (US) 2009-02-24 US disclosed
US-7488766-B2 Polymer composition, method, and article SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2009-02-10 US disclosed
EP-1951814-A1 POLY(ARYLENE ETHER) COMPOSITION, METHOD, AND ARTICLE General Electric Company (US) 2008-08-06 EP disclosed
EP-1940936-A1 POLYMER COMPOSITION, METHOD, AND ARTICLE General Electric Company (US) 2008-07-09 EP disclosed
WO-2007044312-A1 POLY(ARYLENE ETHER) COMPOSITION, METHOD, AND ARTICLE GENERAL ELECTRIC COMPANY (US) 2007-04-19 WO disclosed
WO-2007044489-A1 FLAME RETARDANT COMPOSITION AND METHOD GENERAL ELECTRIC COMPANY (US) 2007-04-19 WO disclosed
WO-2007044294-A1 POLYMER COMPOSITION, METHOD, AND ARTICLE GENERAL ELECTRIC COMPANY (US) 2007-04-19 WO disclosed
US-20070082986-A1 Polymer composition, method, and article SABIC GLOBAL TECHNOLOGIES IP B.V. (NL) 2007-04-12 US disclosed
US-20070080330-A1 Flame retardant composition and method CITIBANK, N.A., AS COLLATERAL AGENT 2007-04-12 US disclosed
US-20070082987-A1 Poly(arylene ether) composition, method, and article SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2007-04-12 US disclosed