SCHEMBL7143941

SCHEMBL7143941

COCc1ccc(C2c3ccccc3C=NN2C=CC=O)cc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.31
ALDH1A1 P00352 2/20 0.31
KMT2A Q03164 2/20 0.31
THRB P10828 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL7142679 0.85
SCHEMBL7142446 0.85 ALDH1A1 (0.42) MEN1ALDH1A1KMT2ATHRBKDM4E
SCHEMBL7141405 0.83 F2 (0.32) ALDH1A1KDM4EMAPT
SCHEMBL7143022 0.83 TDP1 (0.30)
SCHEMBL8067798 0.82 HDAC1 (0.30)
SCHEMBL7135399 0.81 TRPM8 (0.32) MEN1KMT2A
SCHEMBL7145686 0.81 MEN1 (0.31) MEN1ALDH1A1KMT2AMAPT
SCHEMBL7143865 0.81 MAPT (0.32) MAPT
SCHEMBL7137225 0.81 MAPT (0.32) MAPT
SCHEMBL7138487 0.81 MAPT (0.32) MAPT

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-0966464-B1 SUBSTITUTED 2,4-DIAMINOPYRIMIDINES BASILEA PHARMACEUTICA AG (CH) 2003-05-28 EP disclosed
US-6114330-A BACTERICIDES HOFFMANN-LA ROCHE INC. (US) 2000-09-05 US disclosed
EP-0966464-A1 SUBSTITUTED 2,4-DIAMINOPYRIMIDINES F. HOFFMANN-LA ROCHE AG (CH) 1999-12-29 EP disclosed
WO-1998039328-A1 SUBSTITUTED 2,4-DIAMINOPYRIMIDINES F.HOFFMANN-LA ROCHE AG (CH) 1998-09-11 WO disclosed