SCHEMBL14753779

SCHEMBL14753779

CCc1ccc(C2CO2)cc1C1CO1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GSTO1 P78417 1/20 0.40
▸ PARP1 P09874 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CTSB P07858 1/20 0.34
▸ CHRM2 P08172 8/20 0.32
▸ CHRM3 P20309 6/20 0.32
▸ CHRM5 P08912 6/20 0.32
▸ CHRM4 P08173 4/20 0.32
▸ CHRM1 P11229 4/20 0.32
▸ TAAR1 Q96RJ0 1/20 0.31
▸ SLC5A2 P31639 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
SCHEMBL14749897 0.89 PARP1 (0.41) GSTO1PARP1TSHRCTSBCHRM2
SCHEMBL14749894 0.88 DRD2 (0.37) GSTO1CTSB
SCHEMBL18908524 0.80 SLC6A2 (0.35) CTSB
SCHEMBL17141352 0.80 CTSB (0.36) TSHRCTSBCHRM2CHRM3CHRM4
SCHEMBL8358228 0.79 CTSB (0.49) TSHRCTSBCHRM2CHRM3CHRM4
SCHEMBL2054459 0.78 GSTO1 (0.40) GSTO1PARP1TSHRCTSBCHRM2
SCHEMBL28283505 0.77 CTSB (0.47) TSHRCTSBCHRM2CHRM3CHRM4
SCHEMBL7638864 0.76 TSHR (0.46) GSTO1PARP1TSHRCHRM2CHRM3
SCHEMBL24452518 0.73 CYP1A2 (0.50) GSTO1PARP1TSHRCHRM2CHRM3
SCHEMBL17141380 0.72 TAAR1 (0.32) CTSBTAAR1

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-9080046-B2 Epoxybenzyl-terminated poly(arylene ether)s, method for preparation thereof, and curable compositions comprising same SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2015-07-14 — — US disclosed
US-20140058014-A1 EPOXYBENZYL-TERMINATED POLY(ARYLENE ETHER)S, METHOD FOR PREPARATION THEREOF, AND CURABLE COMPOSITIONS COMPRISING SAME SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2014-02-27 — — US disclosed
WO-2013032739-A2 EPOXYBENZYL-TERMINATED POLY(ARYLENE ETHER)S, METHOD FOR PREPARATION THEREOF, AND CURABLE COMPOSITIONS COMPRISING SAME SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2013-03-07 — — WO disclosed
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