SCHEMBL4419720

SCHEMBL4419720

COCCCNc1cc2ncnc(Oc3cccc(F)c3Br)c2cc1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.48
BRD4 O60885 1/20 0.48
ERBB2 P04626 1/20 0.48
ERBB4 Q15303 1/20 0.48
TRPA1 O75762 2/20 0.46
KDR P35968 7/20 0.45
KDM1A O60341 1/20 0.45
RAF1 P04049 4/20 0.42
BRAF P15056 4/20 0.42
MET P08581 3/20 0.42
AURKA O14965 1/20 0.42
TEK Q02763 1/20 0.42
AURKB Q96GD4 1/20 0.42
KMT2A Q03164 1/20 0.41
CSF1R P07333 1/20 0.41
PDGFRB P09619 1/20 0.41
FLT4 P35916 1/20 0.41
FLT3 P36888 1/20 0.41
RET P07949 1/20 0.40
KIF5B P33176 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
SCHEMBL5499555 0.86 TRPA1 (0.52) EGFRBRD4ERBB2ERBB4TRPA1
SCHEMBL4421990 0.76 TRPA1 (0.56) EGFRBRD4ERBB2ERBB4TRPA1
SCHEMBL4424432 0.76 TRPA1 (0.54) EGFRBRD4ERBB2ERBB4TRPA1
SCHEMBL4420603 0.74 PDE5A (0.47) EGFRBRD4ERBB2ERBB4
SCHEMBL4417714 0.73 TRPA1 (0.47) EGFRTRPA1KDRKDM1AAURKA
SCHEMBL4422271 0.70 QPCT (0.46) EGFRTRPA1KDRFLT1
SCHEMBL5497624 0.70 KDM4E (0.56) EGFRERBB2ERBB4TRPA1KDR
SCHEMBL16760478 0.68 KDR (0.64) EGFRTRPA1KDRRAF1BRAF
SCHEMBL23011837 0.67 TRPA1 (0.60) EGFRTRPA1KDRKDM1ARAF1
SCHEMBL4375640 0.65 TRPA1 (0.54) EGFRBRD4ERBB2ERBB4TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498335-B2 Method of producing an antiangiogenic or vascular permeability reducing effect ASTRAZENECA AB (CH) 2009-03-03 US disclosed
US-20030225111-A1 Therapy ASTRAZENECA AB (SE) 2003-12-04 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 (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-20030225111-A1 Therapy VEGFA, AQP1, FLT1 EGFR 1578/4885BRD4 307/4885ERBB2 1966/4885

“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.