SCHEMBL8316035

SCHEMBL8316035

Nc1sc2c(c1C(=O)c1ccccc1Cl)CCN(C(=O)C1CC1)C2

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
LMNA P02545 3/20 0.46
ALDH1A1 P00352 2/20 0.46
GAA P10253 2/20 0.46
ADORA1 P30542 7/20 0.45
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
GRM5 P41594 1/20 0.42
HPGD P15428 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
PDE1B Q01064 1/20 0.40
KCNH2 Q12809 1/20 0.40
PDE10A Q9Y233 1/20 0.40

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
SCHEMBL8316474 0.87 KMT2A (0.52) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL6013476 0.82 ADORA1 (0.56) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL8310230 0.81 ALDH1A1 (0.44) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL8315189 0.79 ALDH1A1 (0.44) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL8311191 0.79 MAPT (0.47) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL8316096 0.78 MAPT (0.55) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL136157 0.77 ALDH1A1 (0.68) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL10447284 0.77 ALDH1A1 (0.64) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL5342374 0.73 MAPT (0.63) MEN1KMT2ALMNAALDH1A1GAA
SCHEMBL7512927 0.72 GAA (0.53) MEN1KMT2ALMNAALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0367110-B1 1,4-diazepine derivative and its pharmaceutical use EISAI CO LTD (JP) 1999-08-11 EP disclosed
US-5482937-A ANTIALLERGENS AND PLATELET ACTIVATING FACTOR FOR TREATMENT OF INFLAMMATION EISAI CO., LTD. (JP) 1996-01-09 US disclosed
US-5468740-A Anti-platelet activating factor activity; antiallergens, antiasthmatics EISAI CO., LTD. (JP) 1995-11-21 US disclosed
EP-0677524-A1 Thieno[3,2-F][1,2,4]triazolo[4,3-A][1,4]diazepine derivatives as PAF antagonists Eisai Co., Ltd. (JP) 1995-10-18 EP disclosed
US-5438045-A An 3-acetyl-6-phenyl-2,3,4,5-tetrahydro-8h-pyrido(4'3':4,5)-thieno(3,2 -f)(1,2,4)triazolo(4,3-a)(1,4)diazepine derivative; antiallergens; asthma; antiplatelet activating factor activity EISAI CO., LTD. (JP) 1995-08-01 US disclosed
US-5409909-A Antiallergens EISAI CO., LTD. (JP) 1995-04-25 US disclosed
US-5382579-A Platelet activating factor antagonists; antiallergens; asthma EISAI CO., LTD. (JP) 1995-01-17 US disclosed
EP-0606103-A1 Thieno 3.2-f 1,2,4 triazolo 4,3-a 1,4 -diazepine derivatives as PAF antagonists Eisai Co., Ltd. (JP) 1994-07-13 EP disclosed
US-5304553-A Antiallergens; platelet activating factor inhibitor EISAI CO., LTD. (JP) 1994-04-19 US disclosed
US-5221671-A Antiallergens, bronchodilator agents EISAI CO., LTD. (JP) 1993-06-22 US disclosed
EP-0367110-A1 1,4-diazepine derivative and its pharmaceutical use Eisai Co., Ltd. (JP) 1990-05-09 EP disclosed