SCHEMBL4042776

SCHEMBL4042776

CC1c2ccccc2-c2n[nH]c(Nc3ccc(F)cc3)c21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
SGK1 O00141 1/20 0.37
DYRK3 O43781 1/20 0.37
EIF4E P06730 1/20 0.37
EIF2AK2 P19525 1/20 0.37
MTOR P42345 1/20 0.37
CSNK1D P48730 1/20 0.37
BRSK2 Q8IWQ3 1/20 0.37
AURKB Q96GD4 1/20 0.37
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
CYP1A2 P05177 8/20 0.36
CYP2D6 P10635 8/20 0.36
CYP2C19 P33261 8/20 0.36
CYP3A4 P08684 7/20 0.36
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 3/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 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
SCHEMBL4041829 0.88 FADS1 (0.42) MEN1KMT2ACSNK1DMKNK1MAPT
SCHEMBL4043023 0.85 HIF1A (0.42) MEN1KMT2AALDH1A1TDP1MAPT
SCHEMBL4045471 0.83 DHODH (0.40) MEN1KMT2AMAPTDHODHNPC1
SCHEMBL4047796 0.81 TDP2 (0.40) KMT2AALDH1A1L3MBTL1NPC1
SCHEMBL4045149 0.80 IDH2 (0.43) ALDH1A1MAPTADORA2ADHODHGRM4
SCHEMBL4048321 0.80 EGFR (0.40) MEN1KMT2ACYP1A2CYP2D6CYP2C19
SCHEMBL4044573 0.77 EGFR (0.44) MEN1KMT2ASGK1DYRK3EIF4E
SCHEMBL4042472 0.77 CHEK1 (0.33) MEN1KMT2ASGK1DYRK3EIF4E
SCHEMBL14571151 0.76 SGK1 (0.32) MEN1KMT2ASGK1DYRK3EIF4E
SCHEMBL3069992 0.73 ABL1 (0.37) MEN1KMT2ACYP2D6CYP2C19CYP3A4

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 10 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
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 MEN1 2796/4885KMT2A 2557/4885SGK1 1295/4885

“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.