SCHEMBL20100393

SCHEMBL20100393

C=C(C(=O)NC(=O)C(F)(F)F)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.42
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CA3 P07451 2/20 0.31
CA5A P35218 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
CA12 O43570 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31

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
SCHEMBL20100302 0.84 CYP1A2 (0.38) CA2ALDH1A1SMN1; SMN2
SCHEMBL18160927 0.81 CA2 (0.53) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL20100291 0.78 CA2 (0.40) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL20100303 0.78 RIPK1 (0.38) ALDH1A1POLB
SCHEMBL2053132 0.74 CA2 (0.59) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL5670996 0.73 CA2 (0.40) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL20100323 0.73 TGM2 (0.30)
SCHEMBL20749882 0.72 CA2 (0.43) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL21470104 0.72 CA2 (0.32) CA2
SCHEMBL10005742 0.72 CA2 (0.32) CA2

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-10042259-B2 Topcoat compositions and pattern-forming methods ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2018-08-07 US disclosed
US-10042259-B2 Topcoat compositions and pattern-forming methods ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2018-08-07 US disclosed
US-20180118970-A1 TOPCOAT COMPOSITIONS AND PATTERN-FORMING METHODS ROHM AND HAAS ELECTRONIC MATERIALS LLC 2018-05-03 US disclosed
US-20180118970-A1 TOPCOAT COMPOSITIONS AND PATTERN-FORMING METHODS ROHM AND HAAS ELECTRONIC MATERIALS LLC 2018-05-03 US disclosed