SCHEMBL4278035

SCHEMBL4278035

CC1(C)c2[nH]nc(NC(=O)c3ccc(N4CCNCC4)cc3)c2CN1S(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 4/20 0.56
CCNA2 P20248 3/20 0.56
CCNA1 P78396 3/20 0.56
NTRK1 P04629 14/20 0.52
NTRK3 Q16288 4/20 0.50
NTRK2 Q16620 4/20 0.50
IGF1R P08069 1/20 0.50
AURKA O14965 1/20 0.47
PAK4 O96013 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
SCHEMBL4279820 0.92 NTRK1 (0.59) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4278072 0.92 NTRK1 (0.59) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4293054 0.89 IGF1R (0.63) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4285353 0.85 NTRK1 (0.57) CDK2CCNA2CCNA1NTRK1IGF1R
SCHEMBL4287193 0.84 NTRK1 (0.64) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4279135 0.83 NTRK1 (0.63) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4285322 0.83 IGF1R (0.64) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4278208 0.81 NTRK1 (0.70) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4279848 0.81 IGF1R (0.73) CDK2CCNA2CCNA1NTRK1NTRK3
SCHEMBL4282966 0.81 NTRK1 (0.65) CDK2CCNA2CCNA1NTRK1NTRK3

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 4 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
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
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 CDK2 2/4885CCNA2 283/4885CCNA1 205/4885

“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.