SCHEMBL4766476

SCHEMBL4766476

CNc1cc(Nc2cccc(CN3CCN(C)CC3)c2)ncn1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
FGFR3 P22607 1/20 0.53
CYP2C19 P33261 1/20 0.53
JAK2 O60674 6/20 0.48
JAK1 P23458 3/20 0.48
TNNI3K Q59H18 1/20 0.47
JAK3 P52333 7/20 0.47
ACP1 P24666 2/20 0.45
MC4R P32245 1/20 0.44
TYK2 P29597 1/20 0.44
PTK2 Q05397 2/20 0.43
CDK2 P24941 2/20 0.43
AURKA O14965 1/20 0.43
PDPK1 O15530 1/20 0.43
CCNA2 P20248 1/20 0.43
CCNA1 P78396 1/20 0.43
PLK1 P53350 1/20 0.42
WEE1 P30291 1/20 0.42

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
SCHEMBL374541 0.91 TNNI3K (0.47) CYP1A2CYP3A4FGFR3CYP2C19JAK2
SCHEMBL374379 0.87 KDM4E (0.46) CYP1A2CYP3A4FGFR3CYP2C19JAK2
SCHEMBL2282067 0.85 TNNI3K (0.66) TNNI3K
SCHEMBL15295501 0.81 FGFR3 (0.59) CYP1A2CYP3A4FGFR3CYP2C19JAK2
SCHEMBL5496809 0.80 MC4R (0.59) JAK2JAK3ACP1MC4RPTK2
Trifluoroacetic Acid SCHEMBL14323756 0.78 TNNI3K (0.56) CYP1A2CYP3A4FGFR3CYP2C19TNNI3K
SCHEMBL374274 0.77 TNNI3K (0.53) CYP1A2CYP3A4FGFR3CYP2C19TNNI3K
SCHEMBL4438331 0.77 CCNT1 (0.55) CYP1A2CYP3A4FGFR3CYP2C19JAK2
SCHEMBL4950163 0.77 KDM1A (0.56) JAK2JAK1JAK3
SCHEMBL374474 0.77 METTL3 (0.47) FGFR3JAK2JAK1TNNI3KJAK3

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 CYP1A2 1058/4885CYP3A4 2061/4885FGFR3 5/4885
US-20130030171-A1 Pyrimidinyl Aryl Urea Derivatives being FGF Inhibitors FGFR1, FGF1, FGF2 CYP1A2 1058/4885CYP3A4 2061/4885FGFR3 5/4885

“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.