SCHEMBL27615449

SCHEMBL27615449

CC(Cc1cccc(O)c1O)CC1CO1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.43
GABRB2 P47870 2/20 0.43
IAPP P10997 4/20 0.37
TRPA1 O75762 1/20 0.35
ELANE P08246 1/20 0.33
CTSG P08311 1/20 0.33
ADAMTS4 O75173 1/20 0.32
ALDH1A1 P00352 1/20 0.32
EGFR P00533 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
LMNA P02545 1/20 0.32
FYN P06241 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
MMP8 P22894 1/20 0.32
CA6 P23280 1/20 0.32
CDK2 P24941 1/20 0.32

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
SCHEMBL5877556 0.78 GABRA1 (0.51) GABRA1GABRB2IAPPTRPA1ELANE
SCHEMBL11284851 0.75 GABRA1 (0.53) GABRA1GABRB2IAPPTRPA1ELANE
SCHEMBL1053654 0.73 GABRA1 (0.79) GABRA1GABRB2IAPPTRPA1ELANE
SCHEMBL29812362 0.73 GABRA1 (0.59) GABRA1GABRB2IAPPTRPA1ELANE
SCHEMBL13907974 0.70 SIGMAR1 (0.44) TRPA1TDP1
SCHEMBL632694 0.70 GABRA1 (0.55) GABRA1GABRB2
SCHEMBL10430786 0.67 GABRA1 (0.50) GABRA1GABRB2IAPPTRPA1ADAMTS4
SCHEMBL5877562 0.67 GABRA1 (0.51) GABRA1GABRB2ELANECTSGALDH1A1
SCHEMBL6700169 0.66 IAPP (0.50) GABRA1GABRB2IAPPELANECTSG
SCHEMBL31498329 0.66 TRPA1 (0.45) GABRA1GABRB2IAPPTRPA1ALDH1A1

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
CN-102574932-A Method for producing modified conjugated diene rubber, and rubber composition JSR CORP 2012-07-11 CN disclosed
CN-100436487-C Polymer well compatible with inorganic fillers ASAHI CHEMICAL CORP (JP) 2008-11-26 CN disclosed
CN-100349962-C Siloxane copolymer, making method, and thermosetting resin composition SHINETSU CHEMICAL CO (JP) 2007-11-21 CN disclosed
CN-1894288-A Polymer well compatible with inorganic fillers ASAHI CHEMICAL CORP (JP) 2007-01-10 CN disclosed
CN-1583835-A Siloxane copolymer, making method, and thermosetting resin composition SHINETSU CHEMICAL CO (JP) 2005-02-23 CN disclosed