SCHEMBL10371944

SCHEMBL10371944

O=C(O)c1cccnc1OC1CCN(Cc2ccc(Cl)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.45
▸ ACHE P22303 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ HRH1 P35367 1/20 0.44
▸ CCR3 P51677 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.42
▸ GAA P10253 1/20 0.41
▸ FAAH O00519 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CCR2 P41597 1/20 0.41
▸ P2RX3 P56373 1/20 0.41
▸ BCHE P06276 1/20 0.41
▸ BACE1 P56817 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
SCHEMBL10371065 0.91 ACHE (0.44) ACHEALDH1A1L3MBTL1KDM4ENPC1
SCHEMBL10372149 0.89 KDM4E (0.47) ACHEL3MBTL1KDM4EHRH1CCR3
SCHEMBL10370515 0.87 ACHE (0.47) ACHEALDH1A1L3MBTL1KDM4ESIGMAR1
SCHEMBL10371952 0.83 KMT2A (0.43) ACHEALDH1A1HRH1CCR3KCNH2
SCHEMBL10372520 0.81 FFAR1 (0.56) SIGMAR1
SCHEMBL10370980 0.78 KMT2A (0.47) —
Hydrochloric Acid SCHEMBL10515122 0.77 ALDH1A1 (0.47) MAPK1ACHEALDH1A1HTTSMN1; SMN2
SCHEMBL10368699 0.75 MCHR1 (0.56) ALDH1A1KDM4EKCNH2SMN1; SMN2BCHE
SCHEMBL10564699 0.74 HRH3 (0.44) MAPK1
SCHEMBL10372099 0.73 ROCK2 (0.41) ALDH1A1KDM4EHRH1CCR3GAA

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-0107930-B1 FUSED AROMATIC OXAZEPINONES AND SULPHUR ANALOGUES THEREOF AND THEIR PREPARATION AND USE IN COUNTERACTING HISTAMINE A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1990-11-28 — — EP disclosed
US-4812565-A ANTIHISTAMINE INTERMEDIATES A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-14 — — US disclosed
US-4810795-A ANTIHISTAMINES A. H. ROBINS COMPANY, INCORPORATED (US) 1989-03-07 — — US disclosed
US-4727152-A Intermediates useful in the preparation of fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof A. H. ROBINS COMPANY, INC. (US) 1988-02-23 — — US disclosed
US-4705853-A ANTIHISTAMINES A. H. ROBINS COMPANY, INC. (US) 1987-11-10 — — US disclosed
US-4642343-A ANTIHISTAMINES A. H. ROBINS COMPANY, INCORPORATED (US) 1987-02-10 — — US disclosed
US-4604388-A Fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof in a method of counteracting histamine A. H. ROBINS COMPANY, INCORPORATED (US) 1986-08-05 — — US disclosed
US-4592866-A Fused aromatic oxazepinones, thiazepinones, diazepinones and sulfur analogs thereof A. H. ROBINS COMPANY, INC. (US) 1986-06-03 — — US disclosed
EP-0107930-A2 Fused aromatic oxazepinones and sulphur analogues thereof and their preparation and use in counteracting histamine A.H. ROBINS COMPANY, INCORPORATED (a Delaware corporation) (US) 1984-05-09 — — EP disclosed
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