SCHEMBL19099004

SCHEMBL19099004

CC(=O)N1CCN(c2ncnc3c(F)c(-c4c(F)ccc(F)c4O)c(Cl)cc23)CC1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KRAS P01116 8/20 0.63
EGFR P00533 1/20 0.63
HMOX2 P30519 1/20 0.63
CRYZ Q08257 1/20 0.63
VAT1 Q99536 1/20 0.63
RTN4 Q9NQC3 1/20 0.63
ACHE P22303 1/20 0.43
BACE1 P56817 1/20 0.43
CNR2 P34972 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
CLK1 P49759 1/20 0.41
PDGFRB P09619 4/20 0.39
PDGFRA P16234 1/20 0.39
AKT1 P31749 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL29765941 0.89 KRAS (0.80) KRASEGFRHMOX2CRYZVAT1
SCHEMBL16647110 0.89 KRAS (0.80) KRASEGFRHMOX2CRYZVAT1
SCHEMBL19296785 0.89 KRAS (0.80) KRASEGFRHMOX2CRYZVAT1
SCHEMBL24850578 0.85 KRAS (0.64) KRASEGFRHMOX2CRYZVAT1
SCHEMBL18128389 0.80 KRAS (0.66) KRASEGFRHMOX2CRYZVAT1
SCHEMBL19296802 0.80 KRAS (0.58) KRASEGFRHMOX2CRYZVAT1
SCHEMBL23092339 0.80 KRAS (0.81) KRASEGFRHMOX2CRYZVAT1
SCHEMBL19695779 0.79 KRAS (0.57) KRASEGFRHMOX2CRYZVAT1
SCHEMBL24850579 0.79 KRAS (0.69) KRASEGFRHMOX2CRYZVAT1
SCHEMBL24535334 0.79 KRAS (0.76) KRASEGFRHMOX2CRYZVAT1

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-9988357-B2 Methods for preparation of quinazoline derivatives ARAXES PHARMA LLC (US) 2018-06-05 US disclosed
US-20170190672-A1 METHODS FOR PREPARATION OF QUINAZOLINE DERIVATIVES ARAXES PHARMA LLC 2017-07-06 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-20170190672-A1 METHODS FOR PREPARATION OF QUINAZOLINE DERIVATIVES TTBK2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, TTBK1 KRAS 1369/4885EGFR 4238/4885HMOX2 4345/4885

“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.