SCHEMBL7472329

SCHEMBL7472329

CN(CCc1ccccc1)C1CCN(C(=O)c2ccc(-n3cncn3)c(O)c2)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.41
DRD4 P21917 2/20 0.39
CHIA Q9BZP6 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL3 Q96JM7 1/20 0.38
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
MGLL Q99685 2/20 0.38
FAAH O00519 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
Hydrochloric Acid SCHEMBL7461110 0.99 GPR119 (0.41) GPR119DRD4CHIANPC1RAB9A
Hydrochloric Acid SCHEMBL7464925 0.92 GPR119 (0.42) GPR119DRD4CHIANPC1RAB9A
SCHEMBL7472375 0.91 SMN1; SMN2 (0.42) GPR119DRD4CHIANPC1RAB9A
SCHEMBL7476326 0.90 GPR119 (0.40) GPR119DRD4CHIANPC1RAB9A
SCHEMBL7476121 0.89 KMT2A (0.44) GPR119MEN1KMT2A
SCHEMBL7469286 0.89 DRD4 (0.40) GPR119DRD4CHIANPC1RAB9A
SCHEMBL9393753 0.89 CHIA (0.42) GPR119DRD4CHIANPC1RAB9A
Hydrochloric Acid SCHEMBL7472415 0.88 KMT2A (0.43) GPR119MEN1KMT2A
SCHEMBL9393732 0.88 GPR119 (0.39) GPR119DRD4CHIANPC1RAB9A
Hydrochloric Acid SCHEMBL7471364 0.88 CHIA (0.42) GPR119DRD4CHIANPC1RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650476-B1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMA CO LTD (JP) 2002-06-26 EP disclosed
US-6136826-A AMINOPIPERIDINE COMPOUNDS SUBSTITUTED WITH ALKANOYL OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
CN-1052224-C Peripheral Vasodilating agent containing N-acylated 4-amino piperidine derivatives as active ingredients OTSUKA PHARMA CO LTD (JP) 2000-05-10 CN disclosed
US-5656642-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-12 US disclosed
WO-1994022826-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-13 WO disclosed