SCHEMBL4050643

SCHEMBL4050643

CC(C)Oc1cc2c(cc1OC(C)C)C(C)c1c-2n[nH]c1Nc1ccc(F)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 5/20 0.41
EGFR P00533 3/20 0.40
FBP1 P09467 2/20 0.35
AURKA O14965 1/20 0.35
ERBB2 P04626 1/20 0.35
INSR P06213 1/20 0.35
PDGFRB P09619 1/20 0.35
FLT4 P35916 1/20 0.35
KDR P35968 1/20 0.35
CLK1 P49759 1/20 0.35
EPHB4 P54760 1/20 0.35
TEK Q02763 1/20 0.35
AURKB Q96GD4 1/20 0.35
P2RX3 P56373 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 1/20 0.33
SOS1 Q07889 1/20 0.33
IDO1 P14902 1/20 0.33

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
SCHEMBL4043198 0.89 EGFR (0.45) GRM4EGFRFBP1AURKAERBB2
SCHEMBL4042472 0.87 CHEK1 (0.33) PDGFRBAURKBP2RX3
SCHEMBL4043851 0.86 FBP1 (0.48) GRM4EGFRFBP1AURKAERBB2
SCHEMBL4046330 0.84 LCK (0.37) GRM4EGFRFBP1PDGFRBFLT4
SCHEMBL4046610 0.80 PDGFRB (0.37) EGFRFBP1ERBB2PDGFRBKDR
SCHEMBL4045102 0.80 PDGFRB (0.39) GRM4EGFRPDGFRBKDRSMN1; SMN2
SCHEMBL4045418 0.79 CHEK1 (0.36) SMN1; SMN2ALDH1A1LMNA
SCHEMBL14570945 0.78 GRM4 (0.41) GRM4AURKAAURKBSMN1; SMN2ALDH1A1
SCHEMBL4044413 0.78 PDGFRB (0.43) GRM4EGFRPDGFRBFLT4KDR
SCHEMBL13887702 0.75 ABL1 (0.34) EGFRFBP1PDGFRBFLT4KDR

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
CN-100396670-C N-substituted 3-aminobenzene-pyrazoles as PDFG receptor inhibitors, pharmaceutical compositions and uses JANSSEN PHARMACEUTICA NV (BE) 2008-06-25 CN 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
CN-1668601-A N-substituted tricyclic 3-aminopyrazoles as PDFG receptor inhibitors JANSSEN PHARMACEUTICA NV (BE) 2005-09-14 CN 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 GRM4 3532/4885EGFR 26/4885FBP1 3497/4885

“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.