SCHEMBL5564873

SCHEMBL5564873

Cc1ccc(Nc2ncnc3[nH]c(Br)cc23)cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 9/20 0.55
RET P07949 3/20 0.55
KIF5B P33176 3/20 0.55
BRAF P15056 4/20 0.54
TNNI3K Q59H18 2/20 0.54
RAF1 P04049 1/20 0.49
EGFR P00533 8/20 0.48
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ABCB1 P08183 1/20 0.43
JAK3 P52333 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.43
ABL1 P00519 1/20 0.43
ABL2 P42684 1/20 0.43
FGFR1 P11362 1/20 0.42
MEN1 O00255 1/20 0.41

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
SCHEMBL5559336 0.84 KDR (0.63) KDRRETKIF5BBRAFTNNI3K
SCHEMBL5559096 0.79 BRAF (0.53) KDRRETKIF5BBRAFTNNI3K
SCHEMBL17282952 0.76 BRAF (0.65) KDRRETBRAFTNNI3KEGFR
SCHEMBL4770875 0.76 CSF1R (0.52) KDRRETKIF5BBRAFTNNI3K
SCHEMBL4768902 0.73 CSF1R (0.51) BRAFTNNI3KEGFR
SCHEMBL16962073 0.72 MKNK1 (0.73) RETBRAFTNNI3KEGFRFLT1
SCHEMBL15618296 0.72 MKNK1 (0.58) KDRBRAFTNNI3KEGFRMAPT
SCHEMBL15618410 0.72 BRAF (0.48) KDRBRAFTNNI3KEGFR
SCHEMBL4768916 0.71 KDR (0.51) KDRRETBRAFTNNI3KEGFR
SCHEMBL5651286 0.71 KDR (1.00) KDRRETKIF5BBRAFRAF1

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-7253166-B2 6-phenyl-7H-pyrrolo[2,3-d]pyrimidine compounds that induce neuronal differentiation in embryonic stem cells IRM LLC (BM) 2007-08-07 US disclosed
US-20050038049-A1 Compounds that induce neuronal differentiation in embryonic stem cells THE SCRIPPS RESEARCH INSTITUTE (US) 2005-02-17 US disclosed
WO-2004093812-A2 COMPOUNDS THAT INDUCE NEURONAL DIFFERENTIATION IN EMBRYONIC STEM CELLS IRM LLC (BM) 2004-11-04 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-20050038049-A1 Compounds that induce neuronal differentiation in embryonic stem cells FER, ERBB3, FLT3 KDR 107/4885RET 15/4885KIF5B 998/4885

“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.