SCHEMBL4043963

SCHEMBL4043963

COCCCOc1ccc2c(c1)Cc1c-2n[nH]c1Nc1cccc(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 5/20 0.45
EGFR P00533 10/20 0.42
PRKCA P17252 6/20 0.42
CDK1 P06493 3/20 0.42
PDGFRA P16234 2/20 0.42
ABL1 P00519 6/20 0.40
SRC P12931 5/20 0.40
FADS1 O60427 1/20 0.38
PLK1 P53350 2/20 0.38
KDR P35968 1/20 0.38
EIF2AK1 Q9BQI3 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL13145982 0.90 PDGFRB (0.44) PDGFRBEGFRPRKCAABL1SRC
SCHEMBL4039006 0.90 PDGFRB (0.46) PDGFRBEGFRPRKCACDK1ABL1
SCHEMBL4047622 0.89 PDGFRB (0.49) PDGFRBKDR
SCHEMBL4049300 0.89 PDGFRB (0.45) PDGFRBPDGFRAABL1SRCKDR
SCHEMBL4038884 0.89 PDGFRB (0.45) PDGFRBEGFRKDRMAPT
SCHEMBL13887544 0.89 PDGFRB (0.39) PDGFRBPDGFRAABL1SRCKDR
SCHEMBL4044208 0.88 PDGFRB (0.52) PDGFRBEGFRPRKCACDK1PDGFRA
SCHEMBL4044195 0.86 PDGFRB (0.48) PDGFRBLMNATP53MAPT
SCHEMBL4049788 0.85 PDGFRB (0.44) PDGFRBEGFRPRKCACDK1PDGFRA
SCHEMBL4048246 0.85 PDGFRB (0.39) PDGFRBKDRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795440-B2 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
US-7795440-B2 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
EP-1506175-B1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-04-01 EP disclosed
EP-1506175-B1 N-SUBSTITUTED TRICYCLIC 3-AMINOPYRAZOLES AS PDGF RECEPTOR INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-04-01 EP disclosed
US-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders HO CHIH Y 2007-06-21 US disclosed
US-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders HO CHIH Y 2007-06-21 US disclosed
US-7196110-B2 N-substituted tricyclic 3-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHAMACEUTICA N.V. (BE) 2007-03-27 US disclosed
US-7196110-B2 N-substituted tricyclic 3-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHAMACEUTICA N.V. (BE) 2007-03-27 US 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 (1 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-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders PDGFRA, PDGFRB, PDGFA PDGFRB 2/4885EGFR 26/4885PRKCA 346/4885

“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.