SCHEMBL8303561

SCHEMBL8303561

Cc1ccn(C)c1-n1nn[nH]c1=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.35
KDM4E B2RXH2 1/20 0.30
KDM6A O15550 1/20 0.30
KDM4A O75164 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KDM5C P41229 1/20 0.30
KDM2B Q8NHM5 1/20 0.30
DOHH Q9BU89 1/20 0.30
KDM2A Q9Y2K7 1/20 0.30

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
SCHEMBL8304692 0.77 KDM4E (0.37) CRBNKDM4EKDM6AKDM4ACYP2C9
SCHEMBL8303651 0.73 CYP1A2 (0.33)
SCHEMBL8309249 0.73 CYP3A4 (0.33)
SCHEMBL8977221 0.71 SMN1; SMN2 (0.47) CYP2C19
SCHEMBL8308197 0.71 ALDH1A1 (0.37) CRBNKDM4E
SCHEMBL8977225 0.70 ALDH1A1 (0.39)
SCHEMBL5906376 0.69 ALDH1A1 (0.44) CRBN
SCHEMBL5906191 0.68 ALDH1A1 (0.42) KDM4E
SCHEMBL8302279 0.68 LPO (0.34) KDM4E
SCHEMBL8977207 0.67 ALDH1A1 (0.39) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0695748-B1 Tetrazolinone herbicides BAYER AGROCHEM KK (JP) 1999-05-06 EP disclosed
US-5589439-A HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 1996-12-31 US disclosed
EP-0695748-A1 Tetrazolinone herbicides NIHON BAYER AGROCHEM K.K. (JP) 1996-02-07 EP disclosed