SCHEMBL4070121

SCHEMBL4070121

CC(Nc1ncc(Br)c(Nc2cc(C3CC3)[nH]n2)n1)c1ccccn1

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 17/20 0.78
NTRK1 P04629 6/20 0.78

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
SCHEMBL4069157 0.88 IGF1R (1.00) IGF1RNTRK1
SCHEMBL29794579 0.88 IGF1R (1.00) IGF1RNTRK1
SCHEMBL4459019 0.88 IGF1R (1.00) IGF1RNTRK1
SCHEMBL4075877 0.88 IGF1R (1.00) IGF1RNTRK1
SCHEMBL3036550 0.86 NTRK1 (0.83) IGF1RNTRK1
SCHEMBL3339415 0.85 IGF1R (0.66) IGF1RNTRK1
SCHEMBL11344767 0.84 IGF1R (1.00) IGF1RNTRK1
SCHEMBL22535808 0.84 NTRK1 (0.55) IGF1RNTRK1
SCHEMBL4144686 0.82 NTRK1 (1.00) IGF1RNTRK1
SCHEMBL11349943 0.82 IGF1R (1.00) IGF1RNTRK1

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
EP-1686999-B1 PYRAZOLE DERIVATIVES AS INHIBITORS OF RECEPTOR TYROSINE KINASES ASTRAZENECA AB (SE) 2009-07-01 EP disclosed
US-20090005396-A1 Use of Pyrazolyl-Pyrimidine Derivatives in the Treatment of Pain ASTRAZENECA AB (SE) 2009-01-01 US disclosed
EP-1877057-A1 USE OF PYRAZOLYL-PYRIMIDINE DERIVATIVES IN THE TREATMENT OF PAIN AstraZeneca AB (SE) 2008-01-16 EP disclosed
WO-2006115452-A1 USE OF PYRAZOLYL-PYRIMIDINE DERIVATIVES IN THE TREATMENT OF PAIN ASTRAZENECA AB (SE) 2006-11-02 WO 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-20090005396-A1 Use of Pyrazolyl-Pyrimidine Derivatives in the Treatment of Pain P2RX3, DPYD, TYMP IGF1R 4775/4885NTRK1 3656/4885

“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.