SCHEMBL17141352

SCHEMBL17141352

CCc1cc(C2CO2)c(CC)cc1C1CO1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CTSB P07858 1/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.36
▸ TSHR P16473 1/20 0.31
▸ CHRM2 P08172 1/20 0.30
▸ CHRM4 P08173 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ CHRM3 P20309 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
SCHEMBL17141380 0.90 TAAR1 (0.32) CTSBTAAR1
SCHEMBL14749897 0.80 PARP1 (0.41) CTSBTAAR1TSHRCHRM2CHRM4
SCHEMBL14753779 0.80 GSTO1 (0.40) CTSBTAAR1TSHRCHRM2CHRM4
SCHEMBL18908524 0.78 SLC6A2 (0.35) CTSB
SCHEMBL8358228 0.76 CTSB (0.49) CTSBTSHRCHRM2CHRM4CHRM1
SCHEMBL14749894 0.76 DRD2 (0.37) CTSB
SCHEMBL12166130 0.74 CHRM2 (0.43) CTSBTSHRCHRM2
SCHEMBL28283505 0.74 CTSB (0.47) CTSBTSHRCHRM2CHRM4CHRM1
SCHEMBL23713578 0.73 — —
SCHEMBL17141358 0.71 TSHR (0.36) CTSBTSHRCHRM2CHRM4CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015153182-A1 EPOXY TWO-PART FORMULATIONS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-10-08 — — WO disclosed
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