SCHEMBL13287232

SCHEMBL13287232

CC(C)=CC(C)(C(=O)OC1CCCC1)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.41
EPHX1 P07099 2/20 0.35
CHRM3 P20309 7/20 0.33
NAAA Q02083 2/20 0.33
HTT P42858 2/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2C19 P33261 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
SCHEMBL12250059 0.98 CYP19A1 (0.43) CYP19A1EPHX1CHRM3NAAAHTT
SCHEMBL14536168 0.79
SCHEMBL14536173 0.79 CYP19A1 (0.41) CYP19A1EPHX1CHRM3NAAAHTT
SCHEMBL13557285 0.78 CYP19A1 (0.43) CYP19A1EPHX1CHRM3NAAAHTT
SCHEMBL14536119 0.78 CYP19A1 (0.38) CYP19A1EPHX1CHRM3NAAAHTT
SCHEMBL14536125 0.76 CYP19A1 (0.40) CYP19A1EPHX1CHRM3NAAAHTT
SCHEMBL9913253 0.76 CYP19A1 (0.41) CYP19A1EPHX1CHRM3NAAAHTT
SCHEMBL12801054 0.76
SCHEMBL14536329 0.74
SCHEMBL14536165 0.74 ALDH1A1 (0.30)

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
WO-2010061977-A2 PATTERN FORMING METHOD USING DEVELOPER CONTAINING ORGANIC SOLVENT AND RINSING SOLUTION FOR USE IN THE PATTERN FORMING METHOD FUJIFILM CORPORATION (JP) 2010-06-03 WO disclosed
US-20070122741-A1 Resist protective coating material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2007-05-31 US disclosed