SCHEMBL17305168

SCHEMBL17305168

Cc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2)c(OCCCC#N)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 8/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ TP53 P04637 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ EPHX2 P34913 1/20 0.42
▸ ALOX5AP P20292 1/20 0.41
▸ FEN1 P39748 1/20 0.41
▸ LMNA P02545 1/20 0.40

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
SCHEMBL18703937 0.88 STS (0.43) GPR119MAPTKDM4ETHRBEPHX2
SCHEMBL12713082 0.83 ALDH1A1 (0.47) GPR119KMT2ATP53MAPTKDM4E
SCHEMBL19013246 0.77 GPR119 (0.55) GPR119KMT2ATP53MAPTKDM4E
SCHEMBL13941529 0.77 GPR119 (0.46) GPR119KMT2ATP53MAPTKDM4E
SCHEMBL12713081 0.76 GPR119 (0.57) GPR119KMT2ATP53MAPTKDM4E
SCHEMBL23721774 0.74 TGFBR1 (0.45) GPR119MAPTKDM4ETHRBEPHX2
SCHEMBL3549233 0.74 GPR119 (0.55) GPR119KMT2ATP53MAPTKDM4E
SCHEMBL17477303 0.74 GPR119 (0.48) GPR119KMT2AMAPTKDM4ETHRB
SCHEMBL12713087 0.74 SMN1; SMN2 (0.48) TP53MAPTKDM4ELMNA
SCHEMBL12713105 0.73 SMN1; SMN2 (0.49) TP53MAPTKDM4ELMNA

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
WO-2015182723-A1 NOVEL PYRROLIDINE COMPOUND AND APPLICATION AS MELANOCORTIN RECEPTOR AGONIST 田辺三菱製薬株式会社 2015-12-03 — — WO disclosed
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