SCHEMBL1923792

SCHEMBL1923792

CC1=C[CH]c2cccc(C)c2C1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 1/20 0.32
ACHE P22303 2/20 0.32
ALDH1A1 P00352 2/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
PARP1 P09874 1/20 0.31
PARP10 Q53GL7 1/20 0.31
PARP11 Q9NR21 1/20 0.31
TSHR P16473 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
SCHEMBL30667121 0.78 CYP2A6 (0.35) CYP1A2CYP2A6ACHEALDH1A1CA1
SCHEMBL5953457 0.78 CYP2A6 (0.35) CYP1A2CYP2A6ACHEALDH1A1CA1
SCHEMBL1923169 0.71 TRPA1 (0.38) CYP1A2ACHEALDH1A1CA1CA2
SCHEMBL16131317 0.69 CA1 (0.38) CYP2A6ACHEALDH1A1CA1CA2
SCHEMBL1923737 0.68 CYP1A2 (0.33) CYP1A2CYP2A6ACHEALDH1A1CA1
SCHEMBL1923251 0.68 CYP1A2 (0.33) CYP1A2CYP2A6ACHEALDH1A1CA1
SCHEMBL28406255 0.65 ACHE (0.42) CYP1A2CYP2A6ACHEALDH1A1CA1
SCHEMBL5954183 0.64 MEN1 (0.33) CYP1A2CYP2A6ACHEALDH1A1
SCHEMBL12602259 0.63
SCHEMBL12602256 0.63 ALDH1A1 (0.32) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328864-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION AND METHOD OF FORMING PATTERN WITH THE COMPOSITION FUJIFILM Corporation (JP) 2011-06-08 EP disclosed
WO-2010035905-A1 ACTINIC RAY-SENSITIVE OR RADIATION-SENSITIVE RESIN COMPOSITION AND METHOD OF FORMING PATTERN WITH THE COMPOSITION FUJIFILM CORPORATION (JP) 2010-04-01 WO disclosed
WO-2009038031-A1 BLOCK COPOLYMER AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-03-26 WO disclosed
EP-1641848-A1 PHOTORESIST POLYMER COMPOSITIONS JSR Corporation (JP) 2006-04-05 EP disclosed
WO-2005003198-A1 PHOTORESIST POLYMER COMPOSITIONS JSR CORPORATION (JP) 2005-01-13 WO disclosed