SCHEMBL9437566

SCHEMBL9437566

O=C1OC(c2ccc3ccccc3c2)=N/C1=C/c1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.81
NOTUM Q6P988 1/20 0.69
ERO1A Q96HE7 1/20 0.59
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 1/20 0.57
MAPT P10636 1/20 0.57
CSNK2A2 P19784 2/20 0.56
CSNK2B P67870 2/20 0.56
CSNK2A1 P68400 2/20 0.56
DAPK3 O43293 8/20 0.56
PLCG2 P16885 1/20 0.54
F2 P00734 1/20 0.52
F10 P00742 1/20 0.52
PLG P00747 1/20 0.52
PLAU P00749 1/20 0.52
PLAT P00750 1/20 0.52
KLKB1 P03952 1/20 0.52
MEN1 O00255 1/20 0.51
POLB P06746 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL9437570 1.00 ALOX5 (0.81) ALOX5NOTUMERO1AKDM4EALDH1A1
SCHEMBL22819051 0.89 ALOX5 (0.77) ALOX5NOTUMERO1AKDM4EALDH1A1
SCHEMBL6790600 0.86 ALOX5 (0.68) ALOX5NOTUMERO1AKDM4EALDH1A1
SCHEMBL6790597 0.86 ALOX5 (0.68) ALOX5NOTUMERO1AKDM4EALDH1A1
SCHEMBL13521556 0.86 ALOX5 (0.68) ALOX5NOTUMERO1AKDM4EALDH1A1
SCHEMBL2131615 0.83 DAPK3 (0.75) ALOX5NOTUMKDM4EALDH1A1MAPT
SCHEMBL2131623 0.83 DAPK3 (0.75) ALOX5NOTUMKDM4EALDH1A1MAPT
SCHEMBL4691058 0.83 DAPK3 (0.75) ALOX5NOTUMKDM4EALDH1A1MAPT
SCHEMBL24534666 0.82 ALOX5 (0.64) ALOX5NOTUMERO1AKDM4EALDH1A1
SCHEMBL25526265 0.82 PLCG2 (0.64) ALOX5NOTUMERO1AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5340802-A Central nervous system disorders ABBOTT LABORATORIES (US) 1994-08-23 US disclosed