SCHEMBL10770096

SCHEMBL10770096

CC(=O)OC(C(=O)NC(C)(C)C)c1cc(Cl)c(N)c(C#N)n1

nearest known ligand 0.31

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.31
▸ ADRB2 P07550 1/20 0.31
▸ ADRB1 P08588 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ ADRA1A P35348 1/20 0.31
▸ OPRK1 P41145 1/20 0.31
▸ SLC6A3 Q01959 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30

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
SCHEMBL9650477 0.86 LMNA (0.35) LMNAADRB2ADRB1HTR1ASLC6A2
SCHEMBL9648721 0.84 LMNA (0.35) LMNAADRB2ADRB1HTR1ASLC6A2
SCHEMBL9649347 0.70 LMNA (0.38) LMNATSHRPOLBKDM4ECYP3A4
SCHEMBL10360151 0.69 ALDH1A1 (0.37) LMNAADRB2ADRB1TSHRPOLB
SCHEMBL9650500 0.69 LMNA (0.39) LMNAADRB2ADRB1HTR1ASLC6A2
SCHEMBL9446788 0.69 — —
SCHEMBL9648708 0.68 LMNA (0.39) LMNAADRB2ADRB1HTR1ASLC6A2
SCHEMBL9646502 0.66 LMNA (0.31) LMNAADRB2ADRB1HTR1ASLC6A2
SCHEMBL9649444 0.64 USP8 (0.31) —
SCHEMBL9648996 0.63 USP8 (0.30) —

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-0244728-A2 Use of heteroarylethyl amines to stimulate animal growth, heteroarylethyl amines and process for their preparation BAYER AG (DE) 1987-11-11 — — EP disclosed
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