SCHEMBL5376307

SCHEMBL5376307

C=Cc1cc2c3c(cccc3c1)C=C2

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
PARP1 P09874 1/20 0.33
AMY1A P0DUB6 1/20 0.31

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
SCHEMBL4403427 0.81 ALDH1A1 (0.35) ALDH1A1AMY1A
Styrene SCHEMBL73353 0.78 ALDH1A1 (0.56) TP53TDP1ALDH1A1TSHR
SCHEMBL2110535 0.77 ALDH1A1 (0.52) TP53TDP1ALDH1A1TSHRPARP1
SCHEMBL4018530 0.75 CYP1A2 (0.43) TP53TDP1ALDH1A1TSHR
Butadiene SCHEMBL9296369 0.74 ALDH1A1 (0.41) TP53ALDH1A1TSHR
4-Vinylphenol SCHEMBL766769 0.74 ALDH1A1 (0.39) TDP1ALDH1A1TSHR
SCHEMBL17183976 0.71 ALDH1A1 (0.47) TP53TDP1ALDH1A1TSHRPARP1
Ethylene SCHEMBL28031639 0.71 ALDH1A1 (0.47) TP53TDP1ALDH1A1TSHRPARP1
SCHEMBL8714064 0.71 CYP1A2 (0.39) ALDH1A1TSHR
SCHEMBL26037 0.71 ALDH1A1 (0.53) TP53TDP1ALDH1A1TSHRPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070248911-A1 Pattern forming method and bilayer film IWASAWA HARUO 2007-10-25 US disclosed
US-7244549-B2 Pattern forming method and bilayer film JSR CORPORATION (JP) 2007-07-17 US disclosed
US-20030073040-A1 Pattern forming method and bilayer film JSR CORPORATION (JP) 2003-04-17 US disclosed