SCHEMBL7746437

SCHEMBL7746437

CCC1(COCC(COCC2(CC)COC2)C(COCC2(CC)COC2)COCC2(CC)COC2)COC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL6765811 0.86 TSHR (0.31) TSHR
SCHEMBL14256290 0.86 TSHR (0.31) TSHR
SCHEMBL439901 0.84 TSHR (0.36) TSHR
SCHEMBL3634587 0.84 ALDH1A1 (0.31) TSHR
SCHEMBL1666633 0.84 TSHR (0.33) TSHR
SCHEMBL12447857 0.84 PRKD3 (0.31) TSHR
SCHEMBL1956406 0.82 TSHR (0.30) TSHR
SCHEMBL19328167 0.82 TSHR (0.30) TSHR
SCHEMBL214376 0.82 HSD17B10 (0.41) TSHR
SCHEMBL13294290 0.82 CTSK (0.31) TSHR

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-6190833-B1 (A) A PHENOL RESIN, (B) AN AMINO RESIN, (C) A COMPOUND HAVING TWO OR MORE CROSSLINKING GROUPS IN A MOLECULE, AND (D) A HALOMETHYL-1,3,5-TRIAZINE COMPOUND. JSR CORPORATION (JP) 2001-02-20 US disclosed