SCHEMBL4049263

SCHEMBL4049263

COC(=O)c1cccc(Nc2[nH]nc3c2Cc2c(OCCCN(C)C)cccc2-3)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.43
BRD4 O60885 1/20 0.38
EP300 Q09472 1/20 0.38
CREBBP Q92793 1/20 0.38
CHEK1 O14757 2/20 0.38
ALDH1A1 P00352 4/20 0.38
LMNA P02545 3/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPK1 P28482 3/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
ROCK1 Q13464 1/20 0.36
MAPT P10636 4/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL4052012 0.87 HIF1A (0.43) PDGFRBCHEK1ALDH1A1HPGDGAA
SCHEMBL13145876 0.86 PDGFRB (0.38) PDGFRBCHEK1ALDH1A1CYP1A2CYP2D6
SCHEMBL4046585 0.86 PDGFRB (0.43) PDGFRBCHEK1ALDH1A1RXFP1SMN1; SMN2
SCHEMBL4043884 0.85 PDGFRB (0.39) PDGFRBCHEK1RXFP1
SCHEMBL4048781 0.85 PLK1 (0.40) PDGFRBCHEK1MAPK1MAPTPOLB
SCHEMBL4047538 0.82 CACNA1B (0.39) PDGFRBCHEK1
SCHEMBL4046728 0.81 SGMS2 (0.36) PDGFRBCHEK1LMNAPRKACA
SCHEMBL27624880 0.80 MRGPRX4 (0.39) CHEK1ALDH1A1CYP3A4CYP2D6CYP2C9
SCHEMBL4042792 0.76 PDGFRB (0.69) PDGFRBBRD4EP300CREBBPCHEK1
SCHEMBL4044195 0.75 PDGFRB (0.48) PDGFRBBRD4EP300CREBBPALDH1A1

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 5 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
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-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 2/4885BRD4 838/4885EP300 1697/4885

“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.