SCHEMBL7143628

SCHEMBL7143628

FC(F)(F)c1ccc(C2NN=Cc3ccccc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTR2A P28223 2/20 0.37
HTR2B P41595 2/20 0.37
HRH3 Q9Y5N1 2/20 0.37
KDM1A O60341 1/20 0.36
ESR1 P03372 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
TSHR P16473 1/20 0.34
KIF11 P52732 1/20 0.34

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
SCHEMBL7143634 1.00 HTR2C (0.38) HTR2CL3MBTL1HTR2AHTR2BHRH3
SCHEMBL7138486 0.85 TNKS2 (0.36) KDM1AMEN1GAAMAPTKMT2A
SCHEMBL7142182 0.83 PRCP (0.44) HTR2CHTR2AHTR2BHRH3GAA
SCHEMBL7142187 0.83 PRCP (0.44) HTR2CHTR2AHTR2BHRH3GAA
SCHEMBL7138440 0.82 PRCP (0.38) ALDH1A1MEN1GAAMAPTKMT2A
SCHEMBL7144064 0.81 MEN1 (0.39) KDM1AMEN1KMT2AKIF11
SCHEMBL4273307 0.81 PRCP (0.45) KDM1AALDH1A1MEN1GAAMAPT
SCHEMBL7143821 0.80 KDM1A (0.37) KDM1AALDH1A1GAAMAPTKMT2A
SCHEMBL7145701 0.80 PRCP (0.44) HTR2CHTR2AHTR2BHRH3GAA
SCHEMBL7143820 0.80 KDM1A (0.37) KDM1AALDH1A1GAAMAPTKMT2A

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 6 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
CN-1091109-C Substituted 2, 4-diaminopyrimidines BASLIER PHARMACEUTICALS AG (CH) 2002-09-18 CN disclosed
US-6114330-A BACTERICIDES HOFFMANN-LA ROCHE INC. (US) 2000-09-05 US disclosed
CN-1249751-A Substituted 2, 4-diaminopyrimidines HOFFMANN LA ROCHE (CH) 2000-04-05 CN 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