SCHEMBL23314866

SCHEMBL23314866

C[C@@H]1CCCN1C(=O)CNC(=O)OC(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51
TSHR P16473 1/20 0.51
KMT2A Q03164 1/20 0.51
FAP Q12884 5/20 0.49
PREP P48147 5/20 0.49
DPP4 P27487 7/20 0.43
EPHX1 P07099 1/20 0.42
DPP8 Q6V1X1 1/20 0.41
DPP9 Q86TI2 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC8 Q9BY41 1/20 0.39

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
SCHEMBL1633733 1.00 MEN1 (0.51) MEN1ALDH1A1TSHRKMT2AFAP
SCHEMBL1633743 0.91 KMT2A (0.53) MEN1ALDH1A1TSHRKMT2AFAP
SCHEMBL1632876 0.86 EPHX1 (0.46) MEN1ALDH1A1TSHRKMT2AFAP
SCHEMBL15765611 0.85 FAP (0.47) KMT2AFAPPREPDPP4DPP8
SCHEMBL3269005 0.85 FAP (0.47) KMT2AFAPPREPDPP4DPP8
SCHEMBL10117317 0.85 FAP (0.47) KMT2AFAPPREPDPP4DPP8
SCHEMBL1633730 0.84 MEN1 (0.50) MEN1ALDH1A1TSHRKMT2AFAP
SCHEMBL21067528 0.84 MEN1 (0.50) MEN1ALDH1A1TSHRKMT2AFAP
SCHEMBL1633565 0.84 SIGMAR1 (0.45) MEN1ALDH1A1TSHRKMT2ADPP4
SCHEMBL14979025 0.83 MEN1 (0.49) MEN1ALDH1A1TSHRKMT2AFAP

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-3145944-B1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2021-05-05 EP disclosed