SCHEMBL22097641

SCHEMBL22097641

CCC(C#N)C(C#N)[C@@H](C)C#N

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 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
SCHEMBL15309645 0.81
SCHEMBL10582999 0.74 TSHR (0.38) TSHR
SCHEMBL5049583 0.73
SCHEMBL24565278 0.72 TSHR (0.33) TSHR
SCHEMBL11304728 0.70
SCHEMBL4274812 0.70
SCHEMBL26316536 0.69
SCHEMBL10582994 0.69 TSHR (0.41) TSHR
SCHEMBL9246735 0.69
SCHEMBL10947198 0.69

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
EP-3667802-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE Sumitomo Seika Chemicals Co. Ltd. (JP) 2020-06-17 EP disclosed