SCHEMBL4863885

SCHEMBL4863885

CNc1cc(Nc2ccc(OCCN(C)C)cc2)ncn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 10/20 0.58
CCNE1 P24864 4/20 0.58
HSF1 Q00613 3/20 0.58
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
CDK4 P11802 12/20 0.52
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
CCNT1 O60563 1/20 0.48
CDK9 P50750 1/20 0.48
ABL1 P00519 1/20 0.47
EGFR P00533 1/20 0.47
PDGFRB P09619 1/20 0.47
KIT P10721 1/20 0.47
FGFR1 P11362 1/20 0.47
SRC P12931 1/20 0.47
BRAF P15056 1/20 0.47
KDR P35968 1/20 0.47
EPHB4 P54760 1/20 0.47
TEK Q02763 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
SCHEMBL374455 0.87 SRC (0.61) CDK2CCNE1HSF1MEN1KMT2A
SCHEMBL1387593 0.84 CDK2 (0.56) CDK2CCNE1HSF1MEN1KMT2A
SCHEMBL12517808 0.80 TNNI3K (0.72) EGFR
SCHEMBL12485614 0.78 MEN1 (0.87) MEN1KMT2ACDK4NPC1RAB9A
SCHEMBL1387382 0.78 MEN1 (0.52) CDK2CCNE1HSF1MEN1KMT2A
SCHEMBL1640720 0.77 HRH3 (0.59)
SCHEMBL374814 0.77 CYP3A4 (0.53) MEN1KMT2ASRCKDREPHB4
SCHEMBL374753 0.76 SRC (0.50) MEN1KMT2ANPC1RAB9AABL1
SCHEMBL4768749 0.76 MEN1 (0.59) MEN1KMT2ACDK4NPC1RAB9A
SCHEMBL374272 0.75 SRC (0.51) MEN1KMT2ANPC1RAB9AABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1976847-B1 PYRIMIDINYL ARYL UREA DERIVATIVES BEING FGF INHIBITORS NOVARTIS AG (CH) 2015-06-17 EP disclosed
US-8759517-B2 Pyrirnidinyl aryl urea derivatives being FGF inhibitors NOVARTIS AG (CH) 2014-06-24 US disclosed
US-20130030171-A1 Pyrimidinyl Aryl Urea Derivatives being FGF Inhibitors NOVARTIS AG (CH) 2013-01-31 US disclosed
US-8293746-B2 Pyrimidinyl aryl urea derivatives being FGF inhibitors NOVARTIS AG (CH) 2012-10-23 US disclosed
US-20080312248-A1 Pyrimidinyl Aryl Urea Derivatives Being Fgf Inhibitors NOVARTIS AG 2008-12-18 US disclosed
EP-1976847-A2 PYRIMIDINYL ARYL UREA DERIVATIVES BEING FGF INHIBITORS Novartis AG (CH) 2008-10-08 EP disclosed
WO-2007071752-A2 PYRIMIDINYL ARYL UREA DERIVATIVES BEING FGF INHIBITORS NOVARTIS AG (CH) 2007-06-28 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-20080312248-A1 Pyrimidinyl Aryl Urea Derivatives Being Fgf Inhibitors FGFR1, FGF1, FGF2 CDK2 24/4885CCNE1 454/4885HSF1 1199/4885
US-20130030171-A1 Pyrimidinyl Aryl Urea Derivatives being FGF Inhibitors FGFR1, FGF1, FGF2 CDK2 24/4885CCNE1 454/4885HSF1 1199/4885

“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.