SCHEMBL4824922

SCHEMBL4824922

Cc1nc(Nc2cccc(C(F)(F)F)c2)c2ccccc2c1Cc1ccc(O)nc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 2/20 0.47
▸ ABCG2 Q9UNQ0 6/20 0.46
▸ EGFR P00533 2/20 0.44
▸ SYK P43405 1/20 0.44
▸ TSHR P16473 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ CACNA1B Q00975 1/20 0.42
▸ APBA1 Q02410 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ CTSC P53634 1/20 0.41
▸ IDH2 P48735 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ P2RX3 P56373 1/20 0.41
▸ NPY1R P25929 1/20 0.40
▸ NPY5R Q15761 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL4828200 0.89 KDR (0.47) KDRABCG2EGFRSYKTSHR
SCHEMBL4828118 0.87 KDR (0.52) KDRABCG2EGFRSYKTSHR
SCHEMBL4824553 0.75 KDM4E (0.48) KDRABCG2EGFRTSHRHTT
SCHEMBL1384909 0.73 KDR (0.50) KDRABCG2EGFRTSHRHTT
SCHEMBL1383441 0.69 EGFR (0.49) KDRABCG2EGFRSYKTSHR
SCHEMBL1382827 0.67 EGFR (0.48) KDRABCG2EGFRSYKTSHR
SCHEMBL787987 0.66 EGFR (0.62) KDRABCG2EGFRTSHRHTT
SCHEMBL12501156 0.65 CYP1A2 (0.65) ABCG2EGFRSYKTSHRHTT
SCHEMBL12501138 0.65 MAPK1 (0.59) KDRABCG2EGFRSYKTSHR
SCHEMBL806052 0.65 ABCG2 (0.64) ABCG2EGFRTSHRHTTCTSC

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7323474-B2 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase NOVARTIS AG (CH) 2008-01-29 — — US disclosed
EP-1254138-B1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE NOVARTIS AG (CH) 2005-05-11 — — EP disclosed
US-20040209894-A1 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase BOLD GUIDO 2004-10-21 — — US disclosed
US-6706731-B2 WITH ISOQUINOLINE DERIVATIVES AS ANTITUMOR AGENTS NOVARTIS AG (CH) 2004-03-16 — — US disclosed
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase NOVARTIS AG (CH) 2003-08-21 — — US disclosed
EP-1254138-A1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE Novartis AG (CH) 2002-11-06 — — EP disclosed
WO-2001058899-A1 PYRIDINE DERIVATIVES INHIBITING ANGIOGENESIS AND/OR VEGF RECEPTOR TYROSINE KINASE NOVARTIS AG (CH) 2001-08-16 — — 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 (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-20040209894-A1 Pyridine derivatives inhibiting angiogenesis and/or VEGF receptor tyrosine kinase FLT1, FLT4, KDR KDR 3/4885ABCG2 835/4885EGFR 15/4885
US-20030158409-A1 Pyridine derivatives inhibiting angiogenesis and/or vegf receptor tyrosine kinase FLT1, FLT4, KDR KDR 3/4885ABCG2 585/4885EGFR 12/4885

“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.

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