SCHEMBL4293077

SCHEMBL4293077

CN1CCN(c2ccc(C(=O)Nc3n[nH]c4c3CN(S(=O)(=O)c3ccc(F)c(F)c3)C4(C)C)cc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 10/20 0.62
NTRK3 Q16288 5/20 0.62
NTRK2 Q16620 5/20 0.62
IGF1R P08069 3/20 0.61
CCNA2 P20248 7/20 0.56
CDK2 P24941 7/20 0.56
CCNA1 P78396 7/20 0.56
AURKA O14965 2/20 0.48
AURKB Q96GD4 2/20 0.48
INSR P06213 1/20 0.47
ALK Q9UM73 1/20 0.47

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
SCHEMBL4287193 0.91 NTRK1 (0.64) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4279848 0.90 IGF1R (0.73) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4285322 0.90 IGF1R (0.64) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4279820 0.88 NTRK1 (0.59) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4282966 0.86 NTRK1 (0.65) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4280719 0.83 IGF1R (0.72) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4293054 0.83 IGF1R (0.63) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4282000 0.82 IGF1R (0.63) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4278208 0.82 NTRK1 (0.70) NTRK1NTRK3NTRK2IGF1RCCNA2
SCHEMBL4278137 0.82 IGF1R (0.79) NTRK1NTRK3NTRK2IGF1RCCNA2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012487-B2 Bicyclo-pyrazoles active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-04-21 US claimed
EP-1999131-B1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-23 EP claimed
US-20090136513-A1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L (IT) 2009-05-28 US claimed
US-9012487-B2 Bicyclo-pyrazoles active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2015-04-21 US disclosed
EP-1999131-B1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-23 EP disclosed
US-20090136513-A1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L (IT) 2009-05-28 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-20090136513-A1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS MAP3K19, CDK2, MAP3K1 NTRK1 1106/4885NTRK3 892/4885NTRK2 1695/4885

“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.