SCHEMBL4424432

SCHEMBL4424432

COc1cc2c(Oc3cccc(F)c3Br)ncnc2cc1OCCN(C)C

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.54
EGFR P00533 8/20 0.53
KDR P35968 7/20 0.53
RET P07949 3/20 0.51
KDM1A O60341 1/20 0.49
BRD4 O60885 1/20 0.48
ERBB2 P04626 1/20 0.48
ERBB4 Q15303 1/20 0.48
KIF5B P33176 2/20 0.47
LCK P06239 1/20 0.47
RAF1 P04049 1/20 0.46
BRAF P15056 1/20 0.46
CSF1R P07333 1/20 0.45
PDGFRB P09619 1/20 0.45
FLT4 P35916 1/20 0.45
FLT3 P36888 1/20 0.45

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
SCHEMBL5492065 0.85 TRPA1 (0.60) TRPA1EGFRKDRRETKDM1A
SCHEMBL4419720 0.76 EGFR (0.48) TRPA1EGFRKDRRETKDM1A
SCHEMBL23721045 0.76 KDR (0.58) EGFRKDRKDM1ALCKRAF1
SCHEMBL4417714 0.75 TRPA1 (0.47) TRPA1EGFRKDRRETKDM1A
SCHEMBL16760478 0.75 KDR (0.64) TRPA1EGFRKDRRETKIF5B
SCHEMBL20897402 0.73 KDR (0.52) TRPA1EGFRKDRRETKDM1A
SCHEMBL4421666 0.72 TRPA1 (0.63) TRPA1EGFRKDRRETERBB2
SCHEMBL4375675 0.72 TRPA1 (0.63) TRPA1EGFRKDRRETERBB2
SCHEMBL4417741 0.72 EGFR (0.53) EGFRKDRRETKIF5BCSF1R
SCHEMBL3951030 0.72 ENPP1 (0.73) EGFRKDRRETKIF5BCSF1R

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 TRPA1 2378/4885EGFR 1578/4885KDR 39/4885

“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.