SCHEMBL13145461

SCHEMBL13145461

CCNc1[nH]nc2c1CCC2

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
CYP1A2 P05177 1/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MAPT P10636 1/20 0.32
POLB P06746 1/20 0.31
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
PKM P14618 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PARP1 P09874 1/20 0.30

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
SCHEMBL18366288 0.75 GAA (0.41) TSHRCYP1A2GAAKDM4EPOLB
SCHEMBL17934689 0.75 ACHE (0.34) TSHRACHEMEN1KMT2A
SCHEMBL20975613 0.71 TSHR (0.40) TSHRCYP1A2GAAKDM4EMAPT
SCHEMBL9947019 0.67
SCHEMBL17232478 0.67 KMT2A (0.37) TSHRCYP1A2GAAKDM4EMAPT
SCHEMBL16629831 0.67 PARP1 (0.38) TSHRCYP1A2GAAKDM4EMAPT
SCHEMBL18366286 0.67 GAA (0.33) TSHRGAAKDM4EKMT2A
SCHEMBL24016772 0.63 MEN1 (0.49) TSHRCYP1A2GAAKDM4EMAPT
SCHEMBL15387773 0.63 KMT2A (0.43) TSHRGAAMAPTPOLBACHE
SCHEMBL18770543 0.63

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 3 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-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

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 TSHR 1579/4885CYP1A2 2542/4885GAA 2705/4885

“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.