SCHEMBL20100334

SCHEMBL20100334

C=C(C)C(=O)NC(=O)C1CCC(C(F)(F)F)CC1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 1/20 0.33
GLA P06280 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
HSD17B10 Q99714 1/20 0.32
POLB P06746 2/20 0.31
NAMPT P43490 1/20 0.31
HTT P42858 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
NPC1 O15118 1/20 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
SCHEMBL20100324 0.83 TGM2 (0.32) PI4KBPOLBALDH1A1HPGDKMT2A
SCHEMBL14925789 0.77 HDAC8 (0.48) SMN1; SMN2HSD17B10POLBHTTALDH1A1
SCHEMBL20100337 0.76 KMT2A (0.32) KMT2A
SCHEMBL17532389 0.76 EPHX1 (0.39) SMN1; SMN2HPGDKMT2ANPC1
SCHEMBL28039756 0.74 CHRNB2 (0.38) PI4KBGLASMN1; SMN2HSD17B10POLB
SCHEMBL4753772 0.72 SMN1; SMN2 (0.38) PI4KBGLASMN1; SMN2POLBHTT
SCHEMBL4753774 0.72 SMN1; SMN2 (0.38) PI4KBGLASMN1; SMN2POLBHTT
SCHEMBL17391740 0.72 EPHX2 (0.36) PI4KBGLA
SCHEMBL12513645 0.72 EPHX2 (0.36) PI4KBGLA
SCHEMBL20100423 0.71 GLA (0.34) PI4KBGLASMN1; SMN2HSD17B10POLB

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