SCHEMBL4466493

SCHEMBL4466493

COc1cc2ncnc(Nc3cccc(Cl)c3F)c2cc1OCCCN1CCOCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 1.00
KCNH2 Q12809 3/20 0.81
SRC P12931 12/20 0.78
KDR P35968 9/20 0.77
FLT4 P35916 2/20 0.77
FGFR1 P11362 2/20 0.77
FLT1 P17948 2/20 0.77
CIT O14578 1/20 0.74
GAK O14976 1/20 0.74
EPHB6 O15197 1/20 0.74
ABCC4 O15439 1/20 0.74
DAPK3 O43293 1/20 0.74
RIPK2 O43353 1/20 0.74
NR1I2 O75469 1/20 0.74
RPS6KA4 O75676 1/20 0.74
STK17B O94768 1/20 0.74
STK10 O94804 1/20 0.74
PRKD3 O94806 1/20 0.74
ABCB11 O95342 1/20 0.74
MAP4K4 O95819 1/20 0.74

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
SCHEMBL6906281 0.92 EGFR (0.86) EGFRKCNH2SRCKDRFLT4
SCHEMBL27315315 0.89 KCNH2 (1.00) EGFRKCNH2SRCKDRFLT4
SCHEMBL13604770 0.89 EGFR (0.80) EGFRKCNH2KDRFLT4FGFR1
SCHEMBL16760391 0.88 EGFR (0.78) EGFRSRCKDRFLT4FGFR1
SCHEMBL15878255 0.87 EGFR (0.78) EGFRKCNH2SRCKDRFLT4
SCHEMBL3668158 0.87 SRC (1.00) EGFRKCNH2SRCKDRFLT4
SCHEMBL3743570 0.87 KDR (1.00) EGFRSRCKDRFLT4FGFR1
SCHEMBL7857964 0.87 KDR (1.00) EGFRKCNH2SRCKDRFLT4
SCHEMBL28350501 0.86 EGFR (0.76) EGFRKCNH2SRCKDRFLT4
SCHEMBL28350781 0.86 EGFR (0.76) EGFRKCNH2SRCKDRFLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582644-B2 Pyrimidyl sulphone amide derivatives as chemokine receptor modulators ASTRAZENECA AB (SE) 2009-09-01 US disclosed
US-20070032457-A1 Combination therapy for cancer treatment INTERMUNE, INC. 2007-02-08 US disclosed
US-20060069109-A1 Therapeutic agents ASTRAZENECA AB (SE) 2006-03-30 US disclosed
US-20060025432-A1 Pyrimidyl sulphone amide derivatives as chemokine receptor modulators ASTRAZENECA AB (SE) 2006-02-02 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 (3 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-20060069109-A1 Therapeutic agents TIE1, TEK, KDR EGFR 33/4885KCNH2 1801/4885SRC 152/4885
US-20070032457-A1 Combination therapy for cancer treatment TP53, BRCA1, FOLH1 EGFR 4/4885KCNH2 4692/4885SRC 505/4885
US-20060025432-A1 Pyrimidyl sulphone amide derivatives as chemokine receptor modulators ACKR3, GPR17, CCL11 EGFR 1432/4885KCNH2 4248/4885SRC 1750/4885

“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.