SCHEMBL1687708

SCHEMBL1687708

CCCCCC(C)c1cc2ccccc2s1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.43
CYP1A2 P05177 2/20 0.43
PTGES O14684 1/20 0.43
LMNA P02545 1/20 0.43
LTA4H P09960 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
ALOX5AP P20292 1/20 0.43
LOX P28300 1/20 0.43
EPHX2 P34913 1/20 0.43
PTGS2 P35354 1/20 0.43
LTB4R Q15722 1/20 0.43
RAB9A P51151 1/20 0.43
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42

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
SCHEMBL21206330 0.89 ALOX5 (0.47) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL8708207 0.82 RAB9A (0.41) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL13326262 0.82 ALOX5 (0.49) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL2387918 0.82 ALOX5 (0.49) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL13187991 0.79 RAB9A (0.47) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL21064546 0.78 RAB9A (0.43) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL23586491 0.77 SLC6A2 (0.46) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL669582 0.76 RAB9A (0.45) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL23615718 0.74 ALOX5 (0.46) ALOX5CYP1A2PTGESLMNALTA4H
SCHEMBL21912351 0.74 SLC6A2 (0.47) ALOX5CYP1A2PTGESLMNALTA4H

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
EP-2452942-A1 SUBSTITUTED BENZOCHALCOGENOACENE COMPOUND, THIN FILM COMPRISING THE COMPOUND, AND ORGANIC SEMICONDUCTOR DEVICE INCLUDING THE THIN FILM Sumitomo Chemical Company, Limited (JP) 2012-05-16 EP disclosed
WO-2012046818-A1 METHOD FOR PRODUCING CHALCOGEN-CONTAINING CONDENSED POLYCYCLIC COMPOUND 住友化学株式会社 (JP) 2012-04-12 WO disclosed