SCHEMBL11075223

SCHEMBL11075223

C=C(CCCC#N)CC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36

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
SCHEMBL60459 0.79 TSHR (0.41) TSHR
SCHEMBL11292505 0.75 TSHR (0.38) TSHR
SCHEMBL15183700 0.73 CAMK2A (0.31)
SCHEMBL60457 0.72 TSHR (0.39) TSHR
SCHEMBL10939348 0.71 GPR84 (0.32) TSHR
SCHEMBL59073 0.70 TSHR (0.38) TSHR
SCHEMBL1004124 0.70
SCHEMBL59578 0.70 TSHR (0.38) TSHR
SCHEMBL60456 0.70 TSHR (0.38) TSHR
SCHEMBL59421 0.70 TSHR (0.38) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3996262-A Method of promoting the reaction of unsaturated nitriles with olefins to produce unsaturated nitriles of increased carbon number PHILLIPS PETROLEUM COMPANY (US) 1976-12-07 US claimed
US-4472319-A Preparation of unsaturated nitriles using a surfactant PHILLIPS PETROLEUM COMPANY (US) 1984-09-18 US disclosed
US-4255352-A TANK REACTORS IN SERIES PHILLIPS PETROLEUM COMPANY (US) 1981-03-10 US disclosed
US-4218394-A FROM UNSATURATED NITRILES AND OLEFINS PHILLIPS PETROLEUM COMPANY (US) 1980-08-19 US disclosed
US-4217303-A UNSATURATED HYDROCARBON, ADDUCT, UNSATURATED DINITRILE, BY-PRODUCT INHIBITION PHILLIPS PETROLEUM COMPANY (US) 1980-08-12 US disclosed
US-4117001-A TO RECOVER STARTING MATERIALS PHILLIPS PETROLEUM COMPANY (US) 1978-09-26 US disclosed
US-4117002-A PYROLYSIS OF HEAVIES FORMED IN PRODUCTION OF UNSATURATED DINITRILES PHILLIPS PETROLEUM COMPANY (US) 1978-09-26 US disclosed
US-3996262-A Method of promoting the reaction of unsaturated nitriles with olefins to produce unsaturated nitriles of increased carbon number PHILLIPS PETROLEUM COMPANY (US) 1976-12-07 US disclosed
US-3985786-A REACTING AN OLEFINICALLY UNSATURATED NITRILE, AN OLEFINIC HYDROCARBON AND THEIR MONOADDUCT IN WATER PHILLIPS PETROLEUM COMPANY (US) 1976-10-12 US disclosed