SCHEMBL5077130

SCHEMBL5077130

CCCCCCCCCCCCCCCCC[CH]SC(C)C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
THRB P10828 1/20 0.38
FAAH O00519 2/20 0.38
TRPV1 Q8NER1 1/20 0.38
DNM1 Q05193 3/20 0.36
EP300 Q09472 1/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL9109797 1.00 TSHR (0.42) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL6435429 0.82 TSHR (0.39) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL3398532 0.73 TSHR (0.39) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL198829 0.72 TSHR (0.48) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL199322 0.72 TSHR (0.48) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL198695 0.72 TSHR (0.48) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL200934 0.72
SCHEMBL200480 0.72 TSHR (0.48) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL387241 0.72 TSHR (0.48) TSHRTHRBFAAHTRPV1DNM1
SCHEMBL198939 0.72 TSHR (0.48) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1697465-B1 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GEN ELECTRIC (US) 2008-02-13 EP disclosed
EP-1697465-A2 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GENERAL ELECTRIC COMPANY (US) 2006-09-06 EP disclosed
WO-2005061623-A2 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GENERAL ELECTRIC COMPANY (US) 2005-07-07 WO disclosed
US-20050137310-A1 Polymer nanocomposites and methods for their preparation CITIBANK, N.A., AS COLLATERAL AGENT 2005-06-23 US disclosed