SCHEMBL20135249

SCHEMBL20135249

Cc1cnc(N2CCN(C(=O)O)[C@H](C(=O)O)C2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 3/20 0.37
OPRK1 P41145 6/20 0.36
CHRM1 P11229 5/20 0.36
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM3 P20309 2/20 0.36
DHODH Q02127 2/20 0.36
SLC6A7 Q99884 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
SMO Q99835 1/20 0.35
OGA O60502 1/20 0.35

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
SCHEMBL3557685 0.75 KDM4E (0.52) OPRK1ALDH1A1HPGD
SCHEMBL27697487 0.74 CHRM1 (0.43) OPRK1CHRM1CHRM2CHRM4CHRM3
SCHEMBL29688884 0.74 EIF2AK4 (0.46)
SCHEMBL20135256 0.74 EIF2AK4 (0.46)
SCHEMBL20135253 0.74 EIF2AK4 (0.46)
SCHEMBL29688824 0.73 GPR119 (0.48) CHRM1CHRM2CHRM4CHRM3
SCHEMBL20134910 0.73 GPR119 (0.48) CHRM1CHRM2CHRM4CHRM3
SCHEMBL20135523 0.73 GPR119 (0.48) CHRM1CHRM2CHRM4CHRM3
SCHEMBL29688701 0.73 GPR119 (0.48) CHRM1CHRM2CHRM4CHRM3
SCHEMBL20134912 0.73 GPR119 (0.48) CHRM1CHRM2CHRM4CHRM3

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-3321256-A1 NOVEL IMIDE DERIVATIVES AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2018-05-16 EP disclosed