SCHEMBL4421974

SCHEMBL4421974

Cc1ccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)cc1N

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.52
HDAC3 O15379 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
MAPK14 Q16539 3/20 0.49
LCK P06239 2/20 0.49
KDR P35968 2/20 0.49
TEK Q02763 1/20 0.49
KIT P10721 2/20 0.49
BTK Q06187 1/20 0.49
PTGS1 P23219 5/20 0.48
RHOC P08134 1/20 0.47
RHOA P61586 1/20 0.47
ABL1 P00519 2/20 0.47
SRC P12931 1/20 0.47
DDR1 Q08345 1/20 0.47
DDR2 Q16832 1/20 0.47
MEN1 O00255 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL1358527 0.92 HDAC3 (0.58) CSF1RHDAC3HDAC8HDAC6MAPK14
SCHEMBL12465329 0.88 P2RY14 (0.53) CSF1RHDAC3HDAC8HDAC6MAPK14
SCHEMBL17413291 0.86 CSF1R (0.53) CSF1RHDAC3HDAC8HDAC6MAPK14
SCHEMBL22025295 0.85 PTGS1 (0.64) KITBTKPTGS1MEN1RAB9A
SCHEMBL4421970 0.85 CSF1R (0.55) CSF1RHDAC3HDAC8HDAC6MAPK14
SCHEMBL4437612 0.85 CSF1R (0.52) CSF1RHDAC3HDAC8HDAC6MAPK14
SCHEMBL4973741 0.85 BRAF (0.51) KDRBRAF
SCHEMBL12464982 0.84 HDAC3 (0.47) CSF1RHDAC3HDAC8HDAC6MAPK14
SCHEMBL29921468 0.84 CSF1R (0.51) CSF1RHDAC3HDAC8HDAC6MAPK14
SCHEMBL29071507 0.84 CSF1R (0.51) CSF1RHDAC3HDAC8HDAC6MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658290-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-04-15 EP claimed
US-7338957-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-03-04 US claimed
JP-2007504159-A 2007-03-01 JP claimed
EP-1658290-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-24 EP claimed
WO-2005039486-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-05-06 WO claimed
EP-1658290-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-04-15 EP disclosed
US-20080275054-A1 3-(Substituted Amino)-Pyrazolo[3, 4-D]Pyrimidines as Ephb and Vegfr2 Kinase Inhibitors HOLZER PHILIPP 2008-11-06 US disclosed
EP-1963327-A1 3-(SUBSTITUTED AMINO)-PYRAZOLO[3,4-d]PYRIMIDINES AS EPHB AND VEGFR2 KINASE INHIBITORS Novartis AG (CH) 2008-09-03 EP disclosed
US-20080108616-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-05-08 US disclosed
US-7338957-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-03-04 US disclosed
WO-2007062805-A1 3-(SUBSTITUTED AMINO)-PYRAZOLO[3,4-d]PYRIMIDINES AS EPHB AND VEGFR2 KINASE INHIBITORS NOVARTIS AG (CH) 2007-06-07 WO disclosed
EP-1658290-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-24 EP disclosed
WO-2005039486-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-05-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080108616-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS LCK, FYN, BMX CSF1R 915/4885HDAC3 1602/4885HDAC8 1854/4885
US-20080275054-A1 3-(Substituted Amino)-Pyrazolo[3, 4-D]Pyrimidines as Ephb and Vegfr2 Kinase Inhibitors EPHB3, EPHB2, EPHB1 CSF1R 818/4885HDAC3 4366/4885HDAC8 4492/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.