SCHEMBL10579490

SCHEMBL10579490

CCCCCC[CH]C[CH]CCCCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
THRB P10828 1/20 0.50
FAAH O00519 2/20 0.46
TRPV1 Q8NER1 2/20 0.46
DNM1 Q05193 3/20 0.45
EP300 Q09472 1/20 0.41
DUSP3 P51452 1/20 0.40
PTPN7 P35236 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL10579601 1.00 TSHR (0.52) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL11860707 0.94 TSHR (0.48) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL11852314 0.94 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL11856199 0.92 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL9668546 0.92 TSHR (0.46) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL11852362 0.91 TSHR (0.43) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL25171013 0.87 TSHR (0.58) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL25171009 0.87 TSHR (0.58) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL25174128 0.87 TSHR (0.58) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL25174145 0.87 TSHR (0.58) TSHRTHRBFAAHTRPV1DNM1

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
US-4861904-A Schiff base metal complex compounds, and organometallic ultrathin film composed thereof and oxygen separation films composed thereof AGENCY OF INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 1989-08-29 US disclosed