SCHEMBL7708213

SCHEMBL7708213

[CH2]CCC[CH]c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.44
AHR P35869 1/20 0.35
MAOB P27338 1/20 0.35
LMNA P02545 1/20 0.35
CYP2A6 P11509 1/20 0.35
TRPA1 O75762 1/20 0.33
CYP1A2 P05177 1/20 0.33
FBP1 P09467 1/20 0.31
KCNH2 Q12809 1/20 0.31
HTT P42858 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 1/20 0.31
GRIN3A Q8TCU5 1/20 0.31
IDO1 P14902 1/20 0.30
G6PC1 P35575 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
SCHEMBL7708200 0.86 HSD17B10 (0.48) HSD17B10AHRMAOBLMNACYP2A6
SCHEMBL2092628 0.79 KCNH2 (0.42) HSD17B10AHRCYP1A2FBP1KCNH2
SCHEMBL2092631 0.79 KCNH2 (0.42) HSD17B10AHRCYP1A2FBP1KCNH2
SCHEMBL8116628 0.78 KCNH2 (0.45) HSD17B10KCNH2
SCHEMBL7702823 0.78 ALDH5A1 (0.44) HSD17B10MAOBLMNATRPA1CYP1A2
SCHEMBL7708248 0.78 CYP2A6 (0.44) CYP2A6FBP1GRIN2DGRIN3BGRIN1
SCHEMBL8936182 0.78 HSD17B10 (0.44) HSD17B10AHRMAOBLMNACYP2A6
SCHEMBL2264621 0.77 ALDH1A1 (0.40) MAOBLMNACYP2A6TRPA1IDO1
SCHEMBL7803552 0.77 HSD17B10 (0.52) HSD17B10AHRMAOBLMNACYP2A6
SCHEMBL11146710 0.75 KCNH2 (0.47) HSD17B10KCNH2

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
CN-1159623-C Radiation-sensitive compsn. of chemical amplification type containing onium salt type photosensitive acid generating agent 克拉瑞特金融(BVI)有限公司 2004-07-28 CN disclosed
US-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
CN-1274433-A Radiation-sensitive compsn. of chemical amplification type containing onium salt type photosensitive acid generating agent CLARIANT INT LTD (CH) 2000-11-22 CN disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed