SCHEMBL20100291

SCHEMBL20100291

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 4/20 0.35
KDM4E B2RXH2 1/20 0.35
POLB P06746 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
EPHX1 P07099 1/20 0.32
TGFBR1 P36897 1/20 0.32
RAB9A P51151 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA3 P07451 2/20 0.30
CA5A P35218 2/20 0.30
CA5B Q9Y2D0 2/20 0.30

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
SCHEMBL20749882 0.80 CA2 (0.43) CA2L3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL18160927 0.79 CA2 (0.53) CA2L3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL24361118 0.79 KDM4E (0.35) L3MBTL1ALDH1A1KDM4EPOLBTDP1
SCHEMBL15045387 0.78 L3MBTL1 (0.39) L3MBTL1ALDH1A1KDM4ESMN1; SMN2TDP1
SCHEMBL18158145 0.78 CA2 (0.42) CA2L3MBTL1ALDH1A1POLBSMN1; SMN2
SCHEMBL20100393 0.78 CA2 (0.42) CA2ALDH1A1POLBSMN1; SMN2MEN1
SCHEMBL7171041 0.76 ALDH1A1 (0.45) CA2ALDH1A1KDM4ETDP1RXFP1
SCHEMBL78126 0.76 ALDH1A1 (0.45) CA2ALDH1A1KDM4ETDP1RXFP1
SCHEMBL24360946 0.76 THRB (0.38) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL8589178 0.74 CA2 (0.48) CA2L3MBTL1ALDH1A1POLBSMN1; SMN2

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