SCHEMBL2559690

SCHEMBL2559690

CC(C)N(C(C)C)C(C)C#N

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
DPP4 P27487 1/20 0.31

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
SCHEMBL2577987 0.86 TSHR (0.47) TSHRDPP4
SCHEMBL16168085 0.73 TSHR (0.41) TSHR
SCHEMBL9150662 0.72 TSHR (0.47) TSHRDPP4
Water SCHEMBL11043959 0.69 TSHR (0.44) TSHRDPP4
SCHEMBL109553 0.69
SCHEMBL9343649 0.69 TSHR (0.44) TSHRDPP4
SCHEMBL10897289 0.69
SCHEMBL17005623 0.69 TSHR (0.37) TSHR
Water SCHEMBL2864553 0.69
SCHEMBL9054151 0.67 TSHR (0.41) TSHRDPP4

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-2382240-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP Bridgestone Corporation (JP) 2011-11-02 EP disclosed
WO-2010085622-A9 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-12-23 WO disclosed
WO-2010085622-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-07-29 WO disclosed
US-5481038-A Borane-N,N-diisopropylalkylamine hydroboration agents ALDRICH CHEMICAL COMPANY, INC. (US) 1996-01-02 US disclosed