SCHEMBL7123713

SCHEMBL7123713

c1nc(Nc2ccc3[nH]ccc3c2)c2sc(-c3ccc(OCCN4CCCC4)cc3)cc2n1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 16/20 0.66
EGFR P00533 14/20 0.66
KDR P35968 2/20 0.65
NTRK1 P04629 1/20 0.56
LTA4H P09960 1/20 0.52
PRKCQ Q04759 2/20 0.50
PRKCD Q05655 1/20 0.49

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
SCHEMBL7128094 0.93 FLT1 (0.63) FLT1EGFRKDRNTRK1PRKCQ
SCHEMBL7123612 0.87 FLT1 (0.78) FLT1EGFRKDR
SCHEMBL7123570 0.85 FLT1 (0.71) FLT1EGFRKDR
SCHEMBL7126436 0.85 FLT1 (0.71) FLT1EGFRKDR
SCHEMBL7115578 0.84 FLT1 (0.75) FLT1EGFRKDR
SCHEMBL7118674 0.84 FLT1 (0.78) FLT1EGFRKDR
SCHEMBL7117833 0.82 EGFR (0.76) FLT1EGFRKDR
SCHEMBL7115414 0.82 FLT1 (0.69) FLT1EGFRKDRNTRK1PRKCQ
SCHEMBL7127001 0.82 EGFR (0.77) FLT1EGFRKDRPRKCQPRKCD
SCHEMBL14777204 0.81 NTRK1 (0.57) FLT1EGFRKDRNTRK1LTA4H

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-20030162795-A1 Thienopyrimidine and thienopyridine derivatives useful as anticancer agents PFIZER INC. 2003-08-28 US claimed
US-6492383-B1 Thienopyrimidine and thienopyridine derivatives useful as anticancer agents PFIZER INC. 2002-12-10 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-20030162795-A1 Thienopyrimidine and thienopyridine derivatives useful as anticancer agents TYMP, DPYD, HPRT1 FLT1 1043/4885EGFR 2961/4885KDR 2362/4885

“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.