SCHEMBL7489809

SCHEMBL7489809

O=Cc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.70
NPSR1 Q6W5P4 1/20 0.70
RAB9A P51151 9/20 0.68
NPC1 O15118 4/20 0.68
MAPT P10636 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
TDP1 Q9NUW8 2/20 0.56
KMT2A Q03164 2/20 0.56
POLB P06746 1/20 0.53
APEX1 P27695 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TSHR P16473 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
ATM Q13315 2/20 0.51
ALDH1A1 P00352 2/20 0.49
MEN1 O00255 1/20 0.48
MAPK1 P28482 1/20 0.48

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
SCHEMBL30084003 1.00 HPGD (0.70) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL3626811 0.93 RAB9A (0.72) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL4728037 0.92 HPGD (0.59) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL28591026 0.91 RAB9A (0.66) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL13969475 0.90 RAB9A (0.64) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL29237869 0.84 HPGD (0.79) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL31030951 0.84 HPGD (0.79) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL1578469 0.84 RAB9A (0.83) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL18074274 0.83 HPGD (1.00) HPGDNPSR1RAB9ANPC1MAPT
SCHEMBL14851782 0.82 HPGD (0.49) HPGDNPSR1RAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111601797-B Benzopiperidine or heteroaryl piperidine derivatives, preparation method and application thereof in medicines 江苏恒瑞医药股份有限公司 2022-11-22 CN disclosed
CN-111601797-A Benzopiperidine or heteroaryl piperidine derivatives, preparation method and application thereof in medicines 江苏恒瑞医药股份有限公司 2020-08-28 CN disclosed
EP-0912567-B1 CARBOLINE DERIVATIVES ICOS CORP (US) 2002-04-10 EP disclosed
US-6306870-B1 PHOSPHODIESTERASE ENZYME INHIBITORS, CARDIOVASCULAR DISORDERS AND SEXUAL DISORDERS ICOS CORPORATION 2001-10-23 US disclosed
US-6117881-A POTENT AND SELECTIVE INHIBITORS OF CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE SPECIFIC PHOSPHODIESTERASE ICOS CORPORATION (US) 2000-09-12 US disclosed
US-6043252-A A POTENT AND SELECTIVE INHIBITORS OF CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE SPECIFIC PHOSPHODIESTERASE (CGMP-SPECIFIC PDE); TREATING CARDIOVASCULAR DISORDERS AND ERECTILE DYSFUNCTION ICOS CORPORATION (US) 2000-03-28 US disclosed
EP-0912567-A1 CARBOLINE DERIVATIVES ICOS CORPORATION (US) 1999-05-06 EP disclosed
WO-1997043287-A1 CARBOLINE DERIVATIVES ICOS CORPORATION (US) 1997-11-20 WO disclosed
US-5478851-A Hyperglycemic agent and antilipemic agent BEECHAM GROUP PLC (GB) 1995-12-26 US disclosed
US-5478850-A Treating hyperglycemia, hyperlipidemia, hypertension BEECHAM GROUP PLC (GB) 1995-12-26 US disclosed
EP-0555249-A1 THIAZOLIDINEDIONE DERIVATIVES BEECHAM GROUP plc (GB) 1993-08-18 EP disclosed
EP-0555264-A1 NOVEL COMPOUNDS BEECHAM GROUP plc (GB) 1993-08-18 EP disclosed
WO-1992007850-A1 NOVEL COMPOUNDS BEECHAM GROUP PLC (GB) 1992-05-14 WO disclosed
WO-1992007839-A1 THIAZOLIDINEDIONE DERIVATIVES BEECHAM GROUP PLC (GB) 1992-05-14 WO disclosed