SCHEMBL4042928

SCHEMBL4042928

Cc1cccc2c1Cc1c-2n[nH]c1Nc1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.38
CYP2D6 P10635 4/20 0.38
CYP2C19 P33261 4/20 0.38
MAPT P10636 4/20 0.38
CYP3A4 P08684 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 2/20 0.38
MAPK1 P28482 2/20 0.38
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ACHE P22303 1/20 0.36
SGK1 O00141 1/20 0.36
MEN1 O00255 1/20 0.36
DYRK3 O43781 1/20 0.36
EIF4E P06730 1/20 0.36
EIF2AK2 P19525 1/20 0.36
MTOR P42345 1/20 0.36
CSNK1D P48730 1/20 0.36
KMT2A Q03164 1/20 0.36
BRSK2 Q8IWQ3 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
SCHEMBL4051009 0.88 ACHE (0.44) CYP1A2CYP2D6CYP2C19MAPTCYP3A4
SCHEMBL4047159 0.88 KDR (0.42) MAPTALDH1A1MAPK1TSHRACHE
SCHEMBL4051511 0.87 DHODH (0.42) MAPTACHEPDGFRBDHODHTNIK
SCHEMBL4366459 0.85 PDGFRB (0.52) CYP1A2CYP2D6CYP2C19CYP3A4ALDH1A1
SCHEMBL4046765 0.84 NPC1 (0.36) MAPTCYP3A4MAPK1TSHRACHE
SCHEMBL4048574 0.84 DHODH (0.42) DHODH
SCHEMBL4042720 0.81 METAP2 (0.39) MAPTALDH1A1MAPK1TDP1ACHE
SCHEMBL4047538 0.78 CACNA1B (0.39) DYRK3KDRPDGFRBCLK4
SCHEMBL4044383 0.76 PDGFRB (0.52) MAPTMAPK1TDP1ACHEMEN1
SCHEMBL4038939 0.75 PDGFRB (0.52) MAPTACHEMEN1CSNK1DKMT2A

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 9 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
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 CYP1A2 2542/4885CYP2D6 3499/4885CYP2C19 1456/4885

“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.