SCHEMBL15499233

SCHEMBL15499233

C=Cc1ccc(C(O)(C(F)(F)F)C(F)(F)F)c(OC(C)=O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
USP2 O75604 1/20 0.40
HPGD P15428 1/20 0.40
CYP2C19 P33261 1/20 0.40
HSD17B10 Q99714 1/20 0.40
JUN P05412 1/20 0.39
NFKB1 P19838 1/20 0.39
TRPA1 O75762 1/20 0.39
PTGS1 P23219 1/20 0.38
KCNJ11 Q14654 3/20 0.36
VCP P55072 1/20 0.36
TUBB4A P04350 2/20 0.35
TUBB P07437 2/20 0.35
TUBA3C P0DPH7 2/20 0.35
TUBA1B P68363 2/20 0.35
TUBA4A P68366 2/20 0.35
TUBB4B P68371 2/20 0.35
TUBB3 Q13509 2/20 0.35
TUBB2A Q13885 2/20 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
SCHEMBL15496921 0.89 JUN (0.39) KDM4EALDH1A1USP2HPGDCYP2C19
SCHEMBL15496919 0.88 KDM4E (0.39) KDM4EALDH1A1USP2HPGDCYP2C19
SCHEMBL7712206 0.87 KDM4E (0.46) KDM4EALDH1A1USP2HPGDCYP2C19
SCHEMBL15499231 0.82 TRPA1 (0.54) KDM4EALDH1A1HPGDTRPA1PTGS1
SCHEMBL31518926 0.77 JUN (0.55) KDM4EALDH1A1JUNNFKB1TRPA1
SCHEMBL726364 0.77 JUN (0.55) KDM4EALDH1A1JUNNFKB1TRPA1
SCHEMBL15496941 0.75 ACHE (0.39) KDM4EKCNJ11ABCC9ABCC8KCNJ8
SCHEMBL685902 0.74 TRPA1 (0.64) KDM4EALDH1A1USP2HPGDCYP2C19
SCHEMBL15499223 0.74 SMN1; SMN2 (0.41) KDM4EALDH1A1HPGDHSD17B10TRPA1
SCHEMBL15496918 0.74 TRPA1 (0.50) ALDH1A1TRPA1PTGS1MEN1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9152050-B2 Resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-10-06 US disclosed
US-20140065546-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-03-06 US disclosed