SCHEMBL21458111

SCHEMBL21458111

CCCCCC(CCCC)(CCCC)OOC(CCCC)(CCCC)CCCCC

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
THRB P10828 1/20 0.39
FDPS P14324 11/20 0.36
GGPS1 O95749 7/20 0.36
SMPD1 P17405 4/20 0.35
CES2 O00748 1/20 0.33
LPAR1 Q92633 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33

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
SCHEMBL22163801 0.97 TSHR (0.41) TSHRTHRBFDPSGGPS1SMPD1
SCHEMBL28461794 0.89 TSHR (0.42) TSHRTHRBFDPSGGPS1SMPD1
SCHEMBL28714061 0.88 TSHR (0.33) TSHRTHRBFDPS
SCHEMBL28618692 0.88 TSHR (0.33) TSHRTHRBFDPS
SCHEMBL27287130 0.86 TSHR (0.37) TSHRTHRBFDPSGGPS1SMPD1
SCHEMBL15657514 0.81 TSHR (0.35) TSHRTHRBFDPSGGPS1SMPD1
SCHEMBL15658084 0.81 TSHR (0.35) TSHRTHRBFDPSGGPS1SMPD1
SCHEMBL15656478 0.81 TSHR (0.35) TSHRTHRBFDPSGGPS1SMPD1
SCHEMBL15659536 0.81 TSHR (0.35) TSHRTHRBFDPSGGPS1SMPD1
SCHEMBL15657416 0.81 TSHR (0.35) TSHRTHRBFDPSGGPS1SMPD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10782624-B2 Binder resin composition for electrostatic image developing toners KAO CORPORATION (JP) 2020-09-22 US disclosed
US-20190317416-A1 BINDER RESIN COMPOSITION FOR ELECTROSTATIC IMAGE DEVELOPING TONERS KAO CORPORATION (JP) 2019-10-17 US disclosed