SCHEMBL9086867

SCHEMBL9086867

O=C(O)Oc1ccccc1CCN1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.51
▸ ALDH1A1 P00352 4/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ MAPT P10636 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ SIGMAR1 Q99720 2/20 0.50
▸ DRD1 P21728 1/20 0.50
▸ DRD4 P21917 1/20 0.50
▸ DRD5 P21918 1/20 0.50
▸ USP2 O75604 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.48
▸ ABCB1 P08183 1/20 0.47

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
SCHEMBL9086865 0.90 SIGMAR1 (0.51) POLBALDH1A1KDM4EMAPTKMT2A
SCHEMBL23926326 0.80 SIGMAR1 (0.79) SIGMAR1KCNH2HRH3
SCHEMBL30118894 0.80 SIGMAR1 (0.79) SIGMAR1KCNH2HRH3
SCHEMBL6043506 0.78 ALDH1A1 (0.55) POLBALDH1A1MAPTKMT2ASIGMAR1
SCHEMBL31696865 0.78 CTSB (0.54) POLBALDH1A1KDM4EMAPTKMT2A
SCHEMBL15020505 0.77 MAPT (0.50) POLBALDH1A1KDM4EMAPTKMT2A
SCHEMBL6006352 0.77 HTR1A (0.46) ABCB1
SCHEMBL487963 0.74 ALDH1A1 (0.56) POLBALDH1A1KDM4EMAPTKMT2A
SCHEMBL10454920 0.74 HRH3 (0.72) POLBALDH1A1KDM4EMAPTKMT2A
Hydrochloric Acid SCHEMBL8521067 0.73 ALDH1A1 (0.50) ALDH1A1MAPTKMT2AKCNH2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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