SCHEMBL4766845

SCHEMBL4766845

COc1ccc(Nc2ncnc3[nH]c(-c4ccc(CO)cc4)cc23)cc1O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RET P07949 5/20 0.54
KIF5B P33176 3/20 0.54
KDR P35968 3/20 0.54
BRAF P15056 5/20 0.54
RAF1 P04049 3/20 0.54
CSF1R P07333 8/20 0.53
EGFR P00533 7/20 0.53
TNNI3K Q59H18 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
SCHEMBL4767215 0.89 RET (0.52) RETKIF5BKDRBRAFRAF1
SCHEMBL8259330 0.88 RET (0.58) RETKIF5BKDRBRAFRAF1
SCHEMBL4767297 0.85 KDR (0.49) RETKIF5BKDRBRAFRAF1
SCHEMBL4766666 0.84 CSF1R (0.59) RETKIF5BKDRBRAFRAF1
SCHEMBL5565132 0.83 RET (0.55) RETKIF5BKDRBRAFRAF1
SCHEMBL4766319 0.83 CSF1R (0.54) RETBRAFCSF1REGFRTNNI3K
SCHEMBL4768562 0.81 RET (0.49) RETKIF5BKDRBRAFRAF1
SCHEMBL5559336 0.79 KDR (0.63) RETKIF5BKDRBRAFRAF1
SCHEMBL4766263 0.78 KDR (0.46) RETKIF5BKDRBRAFRAF1
SCHEMBL4772678 0.78 EGFR (0.55) CSF1REGFR

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-7390805-B2 4-amino-6-phenyl-pyrrolo[2,3-d]pyrimidine derivatives NOVARTIS AG (CH) 2008-06-24 US disclosed
EP-1416935-B1 4-AMINO-6-PHENYL-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2008-03-12 EP disclosed
US-7323469-B2 7H-pyrrolo[2,3-d]pyrimidine derivatives NOVARTIS AG (CH) 2008-01-29 US disclosed
US-7244729-B2 4-amino-6-phenyl-pyrrolo[2,3-d]pyrimidine derivatives NOVARTIS AG (CH) 2007-07-17 US disclosed
US-20070161632-A1 4-AMINO-6-PHENYL-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES BOLD GUIDO 2007-07-12 US disclosed
US-20040248911-A1 7H-pyrrolo[2,3-d]pyrimidine derivatives BOLD GUIDO (CH) 2004-12-09 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 (2 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-20070161632-A1 4-AMINO-6-PHENYL-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES TYMP, DPYD, CCND2 RET 1707/4885KIF5B 3778/4885KDR 1868/4885
US-20040248911-A1 7H-pyrrolo[2,3-d]pyrimidine derivatives DPYD, DHPS, TYMP RET 2696/4885KIF5B 3135/4885KDR 3031/4885

“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.