SCHEMBL4047676

SCHEMBL4047676

COc1cc2c(cc1OCCCN1CCN(C)CC1)Cc1c-2n[nH]c1Nc1ccc(F)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 2/20 0.54
EGFR P00533 13/20 0.54
CHEK1 O14757 5/20 0.53
KDR P35968 2/20 0.51
ERBB2 P04626 2/20 0.50
CIT O14578 1/20 0.50
GAK O14976 1/20 0.50
EPHB6 O15197 1/20 0.50
ABCC4 O15439 1/20 0.50
DAPK3 O43293 1/20 0.50
RIPK2 O43353 1/20 0.50
NR1I2 O75469 1/20 0.50
RPS6KA4 O75676 1/20 0.50
STK17B O94768 1/20 0.50
STK10 O94804 1/20 0.50
PRKD3 O94806 1/20 0.50
ABCB11 O95342 1/20 0.50
MAP4K4 O95819 1/20 0.50
CHEK2 O96017 1/20 0.50
ABL1 P00519 1/20 0.50

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
SCHEMBL4042373 0.96 EGFR (0.57) CSF1REGFRCHEK1KDRERBB2
SCHEMBL4042157 0.94 EGFR (0.59) CSF1REGFRCHEK1KDRERBB2
SCHEMBL4040847 0.89 PDGFRB (0.47) EGFRERBB2
SCHEMBL4045426 0.89 CHEK1 (0.55) EGFRCHEK1KDRSRCFLT4
SCHEMBL4045532 0.89 EGFR (0.47) CSF1REGFRCHEK1KDRERBB2
SCHEMBL4044796 0.88 EGFR (0.52) CSF1REGFRCHEK1KDRERBB2
SCHEMBL4044415 0.87 PDGFRB (0.55) EGFRCHEK1KDRERBB2ABL1
SCHEMBL4042782 0.87 CHEK1 (0.54) CHEK1KDRABL1LCKSRC
SCHEMBL4044252 0.87 EGFR (0.54) CSF1REGFRCHEK1KDR
SCHEMBL4042307 0.87 PDGFRB (0.43) EGFRERBB2

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
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
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 CSF1R 269/4885EGFR 26/4885CHEK1 152/4885

“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.