SCHEMBL16448783

SCHEMBL16448783

Cc1cc(OCCCS(C)(=O)=O)cc(C)c1-c1cccc(CCl)c1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 0.66
GNA15 P30679 1/20 0.53
SLC10A1 Q14973 1/20 0.53
ABCC2 Q92887 1/20 0.53
SLCO1B3 Q9NPD5 1/20 0.53
SLCO1B1 Q9Y6L6 1/20 0.53

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
SCHEMBL16448773 0.89 FFAR1 (0.67) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL1688252 0.88 FFAR1 (0.66) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL203930 0.88 FFAR1 (0.69) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL27895903 0.86 FFAR1 (0.60) FFAR1
SCHEMBL27962432 0.86 FFAR1 (0.63) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL16448792 0.86 FFAR1 (0.69) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL30441627 0.83 FFAR1 (0.61) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL15153514 0.83 FFAR1 (0.78) FFAR1GNA15SLC10A1ABCC2SLCO1B3
SCHEMBL27913199 0.82 FFAR1 (0.59) FFAR1
SCHEMBL16523399 0.82 FFAR1 (0.65) FFAR1GNA15SLC10A1ABCC2SLCO1B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105246875-A Indane derivative, preparation method therefor, and pharmaceutical application thereof SICHUAN HAISCO PHARMACEUTICAL CO LTD 2016-01-13 CN disclosed
CN-104650031-A Aromatic heterocyclic carboxylic acid derivative KBP BIOSCIENCES CO LTD 2015-05-27 CN disclosed
CN-103012343-B Fused-ring derivative and preparation method thereof as well as application of fused-ring derivative in medicine SHANGHAI HENGRUI PHARM CO LTD 2015-04-08 CN disclosed
WO-2015032328-A1 INDANE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL APPLICATION THEREOF 四川海思科制药有限公司 (CN) 2015-03-12 WO disclosed
US-8952185-B2 Production method of optically active dihydrobenzofuran derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-10 US disclosed
US-8952185-B2 Production method of optically active dihydrobenzofuran derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-10 US disclosed
CN-103012343-A Fused-ring derivative and preparation method thereof as well as application of fused-ring derivative in medicine SHANGHAI HENGRUI PHARM CO LTD 2013-04-03 CN disclosed