SCHEMBL8311646

SCHEMBL8311646

C#CCCOC(=O)N1CCC(=O)CC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.37
P2RY12 Q9H244 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.34
POLB P06746 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 5/20 0.32
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL21205899 0.83 CYP1A2 (0.38) MEN1KMT2ASMN1; SMN2POLBLMNA
SCHEMBL1713618 0.78 P2RY12 (0.38) PTGDR2P2RY12MEN1KMT2ASMN1; SMN2
SCHEMBL8313778 0.77 GAA (0.42) P2RY12MEN1KMT2ASMN1; SMN2POLB
SCHEMBL19834261 0.76 MEN1 (0.38) PTGDR2MEN1KMT2A
SCHEMBL13035354 0.75 GAA (0.45) MEN1KMT2ASMN1; SMN2POLBLMNA
SCHEMBL1444915 0.75 SMN1; SMN2 (0.61) MEN1KMT2ASMN1; SMN2POLBLMNA
Ethylene SCHEMBL8377868 0.75 POLB (0.45) MEN1KMT2ASMN1; SMN2POLBLMNA
SCHEMBL158497 0.74 TSHR (0.55) MEN1KMT2ASMN1; SMN2POLBLMNA
SCHEMBL24838326 0.73 ALDH1A1 (0.38) MEN1KMT2ASMN1; SMN2POLBLMNA
SCHEMBL2038483 0.73 POLB (0.41) MEN1KMT2ASMN1; SMN2POLBLMNA

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