SCHEMBL6160168

SCHEMBL6160168

COC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.66
ALDH1A1 P00352 5/20 0.64
HPGD P15428 3/20 0.64
LMNA P02545 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
ATM Q13315 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.59
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
NPC1 O15118 1/20 0.57
MAPT P10636 1/20 0.57
POLB P06746 2/20 0.56
MAPK1 P28482 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
SETD7 Q8WTS6 1/20 0.55

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
SCHEMBL27429792 0.88 ALDH1A1 (0.64) RAB9AALDH1A1HPGDLMNAL3MBTL1
SCHEMBL6777037 0.84 ALDH1A1 (0.67) RAB9AALDH1A1HPGDLMNAL3MBTL1
SCHEMBL10604299 0.84 ALDH1A1 (0.66) ALDH1A1HPGDLMNAL3MBTL1ATM
SCHEMBL7746602 0.83 ALDH1A1 (0.68) RAB9AALDH1A1HPGDLMNAL3MBTL1
SCHEMBL6894997 0.83 RAB9A (0.57) RAB9AALDH1A1HPGDLMNAL3MBTL1
SCHEMBL8298064 0.83 TSHR (0.62) RAB9AALDH1A1HPGDLMNAL3MBTL1
SCHEMBL8884550 0.82 ATM (0.67) ALDH1A1HPGDLMNAL3MBTL1ATM
SCHEMBL8947150 0.82 GAA (0.67) RAB9AALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL8534736 0.82 RAB9A (0.87) RAB9AALDH1A1HPGDLMNAL3MBTL1
SCHEMBL23014104 0.82 ALDH1A1 (0.77) RAB9AALDH1A1HPGDLMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1178969-B1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2005-07-13 EP disclosed
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed
EP-1178969-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2002-02-13 EP disclosed
CN-1325385-A Gastrin and cholecystokinin receptor ligands BLACK JAMES FOUNDATION (GB) 2001-12-05 CN disclosed
WO-2000027823-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-18 WO disclosed
US-RE35281-E ANTIDIABETIC AGENTS WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1996-06-18 US disclosed
EP-0388967-B1 Aldose reductase inhibitor WAKAMOTO PHARMA CO LTD (JP) 1995-06-28 EP disclosed
US-5055481-A Alleviate diabetic complications WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1991-10-08 US disclosed
EP-0388967-A1 Aldose reductase inhibitor Wakamoto Pharmaceutical Co., Ltd. (JP) 1990-09-26 EP disclosed