SCHEMBL9726871

SCHEMBL9726871

CC1=CC(=O)C([N+](=O)[O-])C(C)=N1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1813861 0.63 ALDH1A1 (0.49) ALDH1A1MEN1MAPTKMT2A
SCHEMBL635693 0.61 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2A
Nitric Acid SCHEMBL9726892 0.59 CA5A (0.31)
SCHEMBL3192408 0.57 ALDH1A1 (0.51) ALDH1A1MEN1MAPTKMT2A
SCHEMBL131785 0.51 MEN1 (0.38) MEN1KMT2A
SCHEMBL16178868 0.50
SCHEMBL31678563 0.45 MEN1 (0.75) ALDH1A1MEN1KMT2A
SCHEMBL651428 0.45 MEN1 (0.75) ALDH1A1MEN1KMT2A
SCHEMBL4365635 0.44 MEN1 (0.33) MEN1KMT2A
SCHEMBL8967528 0.44

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
CN-1032648-C Process for preparation of platelet activating factor antagonist FIZER LTD (GB) 1996-08-28 CN disclosed
US-5149814-A Alkyl 2-benzylidene-4-(2-alkylimidazopyrid-1-yl) benzoylacetate esters as intermediate compounds PFIZER INC (US) 1992-09-22 US disclosed
US-5120747-A Antiallergens, antiinflammatory agent PFIZER INC. (US) 1992-06-09 US disclosed
US-5070205-A Chemical intermediate for anticoagulants PFIZER INC. (US) 1991-12-03 US disclosed
EP-0310386-B1 4-ARYL-5-CARBAMOYL-1,4-DIHYDROPYRIDINES Pfizer Limited (GB) 1991-11-06 EP disclosed
US-5063237-A Antiallergens and antiinflammatory agents PFIZER INC. (US) 1991-11-05 US disclosed
US-4935430-A Platelet activating factor antagonists PFIZER INC. (US) 1990-06-19 US disclosed
CN-1032439-A A kind of preparation method of platelet-activating factor antagonist PFIZER LTD (GB) 1989-04-19 CN disclosed
EP-0310386-A2 4-Aryl-5-carbamoyl-1,4-dihydropyridines Pfizer Limited (GB) 1989-04-05 EP disclosed