SCHEMBL10504356

SCHEMBL10504356

Nc1cccc2occc(=O)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.48
MAOA P21397 2/20 0.48
FTO Q9C0B1 2/20 0.48
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
ALDH1A1 P00352 4/20 0.37
DYRK1A Q13627 1/20 0.36
JAK2 O60674 1/20 0.35
RPS6KA3 P51812 1/20 0.35
MELK Q14680 1/20 0.35
STK24 Q9Y6E0 1/20 0.35
KDM4E B2RXH2 3/20 0.33
KCNA3 P22001 1/20 0.33
NQO1 P15559 1/20 0.33
ACHE P22303 1/20 0.33
GAA P10253 1/20 0.33
GRM5 P41594 1/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL10506813 0.80 ESR1 (0.35) MAOBMAOAFTOESR1ESR2
SCHEMBL11412674 0.78 MAOB (0.50) MAOBMAOAFTOALDH1A1KDM4E
SCHEMBL29960477 0.76 AR (0.49) MAOBMAOAFTOALDH1A1KDM4E
SCHEMBL29568413 0.76 MAOB (0.48) MAOBMAOAFTOALDH1A1KDM4E
SCHEMBL1857840 0.76 HTR2B (0.50) MAOBMAOAFTOALDH1A1KDM4E
SCHEMBL30111795 0.76 HTR2B (0.50) MAOBMAOAFTOALDH1A1KDM4E
SCHEMBL546446 0.76 MAOB (0.48) MAOBMAOAFTOALDH1A1KDM4E
SCHEMBL10506818 0.76 MAOB (0.44) MAOBMAOAFTOALDH1A1DYRK1A
SCHEMBL10765471 0.76 MAOB (0.48) MAOBMAOAFTOALDH1A1KDM4E
SCHEMBL28632877 0.73 DYRK1A (0.37) MAOBMAOAFTODYRK1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0163227-B1 5-SUBSTITUTED CHROMONES AND THIOCHROMONES MILES INC. (US) 1989-08-02 EP disclosed
US-4639535-A INTERMEDIATES FOR ANTIALLERGENS MILES LABORATORIES, INC. (US) 1987-01-27 US disclosed
US-4571405-A Anti-allergic chromone- or thiochromone-5-oxamic acid derivatives, compositions, and method of use therefor MILES LABORATORIES, INC. (US) 1986-02-18 US disclosed
EP-0163227-A1 5-Substituted chromones and thiochromones MILES INC. (US) 1985-12-04 EP disclosed