SCHEMBL9125334

SCHEMBL9125334

O=C1c2ccccc2C(=O)N1C(N1C(=O)c2ccccc2C1=O)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CASP1 P29466 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ CASP3 P42574 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ EHMT2 Q96KQ7 1/20 0.38
▸ EHMT1 Q9H9B1 1/20 0.38
▸ MEN1 O00255 3/20 0.36
▸ KMT2A Q03164 3/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ GLS O94925 1/20 0.36
▸ SCN2A Q99250 1/20 0.36
▸ CDC25B P30305 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ NR1H3 Q13133 2/20 0.35
▸ NR1H2 P55055 1/20 0.35

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
SCHEMBL2707925 0.81 POLB (0.43) CASP1POLBCASP3CYP1A2EHMT2
SCHEMBL9342906 0.80 CASP1 (0.40) CASP1POLBCASP3CYP1A2EHMT2
SCHEMBL8730348 0.77 MEN1 (0.41) CASP1POLBCASP3CYP1A2EHMT2
SCHEMBL1961000 0.77 KMT2A (0.41) CASP1POLBCASP3CYP1A2EHMT2
SCHEMBL9549241 0.77 CASP1 (0.38) CASP1POLBCASP3CYP1A2EHMT2
SCHEMBL9190585 0.75 POLB (0.46) POLBCASP3CYP1A2EHMT2EHMT1
SCHEMBL31288119 0.72 DPP4 (0.40) CASP1POLBCASP3CYP1A2EHMT2
SCHEMBL5940982 0.71 MEN1 (0.43) POLBCASP3CYP1A2EHMT2EHMT1
SCHEMBL30472938 0.71 CASP3 (0.46) POLBCASP3CYP1A2EHMT2EHMT1
SCHEMBL2156119 0.71 CASP3 (0.46) POLBCASP3CYP1A2EHMT2EHMT1

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-5449740-A Resin systems derived from insitu-generated bisdienes from bis-benzocyclobutene compounds THE UNIVERSITY OF DAYTON (US) 1995-09-12 — — US disclosed
EP-0402632-A2 Aromatic polyimide silanol compounds, precursors and polymers thereof Hughes Aircraft Company (US) 1990-12-19 — — EP disclosed
US-4864047-A Aminophenoxyphosphazenes and process for producing same THE DOW CHEMICAL COMPANY (US) 1989-09-05 — — US disclosed
US-4745206-A Aminophenoxyphosphazenes and a process for producing same THE DOW CHEMICAL COMPANY (US) 1988-05-17 — — US disclosed
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