SCHEMBL8102276

SCHEMBL8102276

COC(=O)c1ccc(CCN(C)C2CCN(C(=O)c3ccc(-n4cncn4)cc3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.48
L3MBTL3 Q96JM7 1/20 0.41
DPP4 P27487 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LSS P48449 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
HPGD P15428 1/20 0.39
SMYD3 Q9H7B4 1/20 0.39
MCHR1 Q99705 1/20 0.39
NAMPT P43490 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
PRKAB2 O43741 1/20 0.38

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
SCHEMBL7473019 0.91 GPR119 (0.48) GPR119L3MBTL3MEN1KMT2AALDH1A1
SCHEMBL7475656 0.89 GPR119 (0.47) GPR119L3MBTL3DPP4MEN1KMT2A
SCHEMBL7473126 0.89 GPR119 (0.47) GPR119L3MBTL3DPP4ALDH1A1SMN1; SMN2
SCHEMBL7471264 0.89 GPR119 (0.48) GPR119L3MBTL3DPP4KMT2AALDH1A1
SCHEMBL7472799 0.87 GPR119 (0.46) GPR119L3MBTL3DPP4MEN1KMT2A
SCHEMBL9393047 0.87 KMT2A (0.48) GPR119MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7466797 0.86 GPR119 (0.43) GPR119L3MBTL3DPP4ALDH1A1HPGD
Hydrochloric Acid SCHEMBL7468175 0.86 KMT2A (0.47) GPR119MEN1KMT2AALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL7463342 0.85 GPR119 (0.44) GPR119L3MBTL3DPP4MEN1KMT2A
SCHEMBL7462540 0.83 GPR119 (0.45) GPR119L3MBTL3DPP4MEN1KMT2A

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
US-6136826-A AMINOPIPERIDINE COMPOUNDS SUBSTITUTED WITH ALKANOYL OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
US-5760058-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-06-02 US disclosed
US-5656642-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-12 US disclosed
EP-0650476-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-05-03 EP 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