SCHEMBL5844206

SCHEMBL5844206

Fc1ccc(Nc2ncnc3cc4c(cc23)OCCOCCOCCO4)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 1.00
GAK O14976 1/20 0.60
RIPK2 O43353 1/20 0.60
BUB1 O43683 1/20 0.60
STK10 O94804 1/20 0.60
CARS1 P49589 1/20 0.60
MAP3K1 Q13233 1/20 0.60
PIP4K2C Q8TBX8 1/20 0.60
SLK Q9H2G2 1/20 0.60
AURKA O14965 1/20 0.59
ERBB2 P04626 1/20 0.59
INSR P06213 1/20 0.59
FBP1 P09467 1/20 0.59
PDGFRB P09619 1/20 0.59
FLT4 P35916 1/20 0.59
KDR P35968 1/20 0.59
CLK1 P49759 1/20 0.59
EPHB4 P54760 1/20 0.59
TEK Q02763 1/20 0.59
AURKB Q96GD4 1/20 0.59

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
SCHEMBL5845243 0.87 EGFR (0.77) EGFRAURKAERBB2INSRFBP1
SCHEMBL5843856 0.86 EGFR (0.74) EGFRAURKAERBB2INSRFBP1
SCHEMBL5843315 0.84 EGFR (1.00) EGFRGAKRIPK2BUB1STK10
SCHEMBL15928071 0.83 EGFR (1.00) EGFRAURKAERBB2INSRFBP1
SCHEMBL15928222 0.81 EGFR (0.89) EGFRAURKAERBB2INSRFBP1
SCHEMBL28403915 0.81 EGFR (0.74) EGFRAURKAERBB2INSRFBP1
SCHEMBL16449752 0.80 EGFR (1.00) EGFRGAKRIPK2BUB1STK10
SCHEMBL21967048 0.80 EGFR (0.76) EGFRGAKRIPK2BUB1STK10
SCHEMBL28407489 0.80 EGFR (0.76) EGFRGAKRIPK2STK10PIP4K2C
SCHEMBL363708 0.79 EGFR (0.65) EGFRGAKRIPK2BUB1STK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7078409-B2 Fused quinazoline derivatives useful as tyrosine kinase inhibitors BETA PHARMA, INC. (US) 2006-07-18 US claimed
US-20040048883-A1 Novel fused quinazoline derivatives useful as tyrosine kinase inhibitors BETA PHARMA, INC. 2004-03-11 US claimed
WO-2003082830-A1 NOVEL FUSED QUINAZOLINE DERIVATIVES USEFUL AS TYROSINE KINASE INHIBITORS BETA PHARMA, INC. (US) 2003-10-09 WO claimed
US-7078409-B2 Fused quinazoline derivatives useful as tyrosine kinase inhibitors BETA PHARMA, INC. (US) 2006-07-18 US disclosed
US-20040048883-A1 Novel fused quinazoline derivatives useful as tyrosine kinase inhibitors BETA PHARMA, INC. 2004-03-11 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-20040048883-A1 Novel fused quinazoline derivatives useful as tyrosine kinase inhibitors ABL1, ERBB2, CNKSR1 EGFR 82/4885GAK 517/4885RIPK2 998/4885

“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.