SCHEMBL7869540

SCHEMBL7869540

CCOC(=O)CC(=O)c1ccc(-n2c(C)nc3cnccc32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 2/20 0.45
DRD1 P21728 1/20 0.43
TP53 P04637 1/20 0.43
ROCK2 O75116 1/20 0.42
HSD17B10 Q99714 1/20 0.41
ATM Q13315 1/20 0.41

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
SCHEMBL8329396 0.91 MEN1 (0.46) MEN1KMT2AMAPTDRD1ROCK2
SCHEMBL7876035 0.87 ALOX15 (0.48) MEN1KMT2ATP53ROCK2HSD17B10
SCHEMBL7873335 0.87 CRBN (0.41) MEN1KMT2AMAPT
SCHEMBL9559464 0.86 HSD17B10 (0.47) MEN1KMT2ADRD1ROCK2HSD17B10
SCHEMBL9384000 0.86 POLB (0.38) MEN1KMT2AMAPTDRD1TP53
SCHEMBL9726878 0.85 MAPK1 (0.52) MAPTTP53HSD17B10
SCHEMBL9727194 0.84 TP53 (0.46) MEN1KMT2AMAPTTP53ROCK2
SCHEMBL9332729 0.84 MEN1 (0.46) MEN1KMT2ADRD1TP53
Hydrochloric Acid SCHEMBL9697856 0.81 MEN1 (0.45) MEN1KMT2ADRD1HSD17B10
Hydrochloric Acid SCHEMBL9523368 0.81 MEN1 (0.45) MEN1KMT2ADRD1HSD17B10

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6306853-B1 DICARBOXYLIC ESTER DERIVATIVES OF DIHYDROPYRIDINE COMPOUNDS NIKKEN CHEMICALS CO., LTD. (JP) 2001-10-23 US disclosed
EP-1055672-A1 1,4-DIHYDROPYRIDINE DERIVATIVES Nikken Chemicals Company, Limited (JP) 2000-11-29 EP disclosed
EP-0943615-A1 1,4-DIHYDROPYRIDINE DERIVATIVES Nikken Chemicals Company, Limited (JP) 1999-09-22 EP disclosed
EP-0389189-B1 Diazepine antiallergy agents PFIZER LTD (GB) 1994-05-18 EP disclosed
EP-0466711-B1 DIHYDROPYRIMIDINE ANTIALLERGY AGENTS PFIZER LTD (GB) 1993-10-27 EP disclosed
EP-0462986-B1 IMIDAZOPYRIMIDINE ANTIALLERGY AGENTS Pfizer Limited (GB) 1993-10-06 EP disclosed
US-5248681-A DIHYDROPYRIDINE ANTIALLERGY AGENTS PFIZER INC. (US) 1993-09-28 US disclosed
EP-0551291-A1 THERAPEUTIC (PAF ANTAGONISTS) AGENTS Pfizer Limited (GB) 1993-07-21 EP disclosed
EP-0548125-A1 SUBSTITUTED 6,7-DIHYDROIMIDAZO(1,5,4-EF)(1,5)BENZODIAZEPIN-6-ONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS Pfizer Limited (GB) 1993-06-30 EP disclosed
US-5214044-A Antiallergens PFIZER INC. (US) 1993-05-25 US disclosed
US-5008263-A Platelet activating factor antagonists; antiallergens; antiinflammatory agents PFIZER INC. (US) 1991-04-16 US disclosed
WO-1990012015-A1 DIHYDROPYRIDINE ANTIALLERGY AGENTS PFIZER LIMITED (GB) 1990-10-18 WO disclosed
US-4963560-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1990-10-16 US disclosed
WO-1990011281-A1 DIHYDROPYRIMIDINE ANTIALLERGY AGENTS PFIZER LIMITED (GB) 1990-10-04 WO disclosed
WO-1990011280-A1 1,4-DIHYDROPYRIDINES PFIZER LIMITED (GB) 1990-10-04 WO disclosed
EP-0389189-A2 Diazepine antiallergy agents Pfizer Limited (GB) 1990-09-26 EP disclosed
WO-1990010632-A1 IMIDAZOPYRIMIDINE ANTIALLERGY AGENTS PFIZER LIMITED (GB) 1990-09-20 WO disclosed
US-4935430-A Platelet activating factor antagonists PFIZER INC. (US) 1990-06-19 US disclosed
EP-0365140-A1 1,4-Dihydropyridine derivatives Pfizer Limited (GB) 1990-04-25 EP disclosed
EP-0310386-A2 4-Aryl-5-carbamoyl-1,4-dihydropyridines Pfizer Limited (GB) 1989-04-05 EP disclosed