SCHEMBL862071

SCHEMBL862071

NC[C@H]1CC[C@H](N(Cc2ccccc2)C(=O)O)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AGER Q15109 3/20 0.47
MTNR1A P48039 1/20 0.47
CHRM2 P08172 1/20 0.47
CHRM3 P20309 1/20 0.47
OPRM1 P35372 6/20 0.46
CTSD P07339 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MC4R P32245 3/20 0.43
MC5R P33032 3/20 0.43
MC3R P41968 3/20 0.43
SMYD3 Q9H7B4 1/20 0.42
DPP4 P27487 1/20 0.41
DPP9 Q86TI2 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
DCUN1D1 Q96GG9 1/20 0.41

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
SCHEMBL862072 1.00 AGER (0.47) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL3370759 0.88 AGER (0.55) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL77425 0.84 MC4R (0.54) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL738277 0.84 MC4R (0.54) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL736913 0.82 AGER (0.50) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL736914 0.82 AGER (0.50) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL2400009 0.81 OPRM1 (0.51) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL13275447 0.81 OPRM1 (0.51) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL2400012 0.81 OPRM1 (0.51) AGERMTNR1ACHRM2CHRM3OPRM1
SCHEMBL481562 0.80 YTHDC1 (0.49) MEN1KMT2AMC4RMC5RMC3R

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-2432760-A1 BRIDGED SPIRO [2.4]HEPTANE DERIVATIVES AS ALX RECEPTOR AND/OR FPRL2 AGONISTS Actelion Pharmaceuticals Ltd. (CH) 2012-03-28 EP disclosed