SCHEMBL2450897

SCHEMBL2450897

CO/N=C\c1c(N)ncnc1OCc1cc(Br)ccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RET P07949 4/20 0.51
EGFR P00533 4/20 0.48
ERBB2 P04626 4/20 0.48
KDR P35968 14/20 0.48
CSF1R P07333 1/20 0.46
KIT P10721 1/20 0.46
PDGFRA P16234 1/20 0.46
FLT1 P17948 1/20 0.46
FLT4 P35916 1/20 0.46
FLT3 P36888 1/20 0.46

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
SCHEMBL12303650 1.00 RET (0.51) RETEGFRERBB2KDRCSF1R
SCHEMBL2450900 1.00 RET (0.51) RETEGFRERBB2KDRCSF1R
SCHEMBL2453192 0.89 RET (0.52) RETEGFRERBB2KDRCSF1R
SCHEMBL2453193 0.89 RET (0.52) RETEGFRERBB2KDRCSF1R
SCHEMBL12303598 0.89 RET (0.52) RETEGFRERBB2KDRCSF1R
SCHEMBL2450555 0.83 EGFR (0.39) RETEGFRERBB2KDRCSF1R
SCHEMBL12303593 0.82 RET (0.57) RETEGFRERBB2KDRCSF1R
SCHEMBL2455955 0.82 RET (0.57) RETEGFRERBB2KDRCSF1R
SCHEMBL2455951 0.82 RET (0.57) RETEGFRERBB2KDRCSF1R
SCHEMBL2453292 0.81 EGFR (0.54) RETEGFRERBB2KDRCSF1R

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-8013153-B2 Substituted pyrimidine kinase inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2011-09-06 US claimed
US-20070254896-A1 SUBSTITUTED PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-11-01 US claimed
WO-2007109783-A2 SUBSTITUTED PYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-09-27 WO claimed

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-20070254896-A1 SUBSTITUTED PYRIMIDINE KINASE INHIBITORS DTYMK, TK1, DCK RET 577/4885EGFR 1449/4885ERBB2 325/4885

“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.