SCHEMBL3949228

SCHEMBL3949228

COc1cc2ncnc(Cl)c2cc1OCCN1CCN(C)CC1

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 3/20 0.65
KDR P35968 9/20 0.62
EGFR P00533 7/20 0.62
FGFR1 P11362 4/20 0.62
FLT1 P17948 4/20 0.62
FLT4 P35916 3/20 0.62
EPHA2 P29317 3/20 0.56
EPHB4 P54760 3/20 0.56
KIT P10721 1/20 0.55
RET P07949 1/20 0.55
ACHE P22303 1/20 0.55
BACE1 P56817 1/20 0.55
AURKA O14965 1/20 0.54
KDM1A O60341 1/20 0.53
SRC P12931 1/20 0.52

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
SCHEMBL3954618 1.00 ENPP1 (0.65) ENPP1KDREGFRFGFR1FLT1
SCHEMBL2190137 0.94 ENPP1 (0.64) ENPP1KDREGFRFGFR1FLT1
SCHEMBL2188204 0.94 ENPP1 (0.64) ENPP1KDREGFRFGFR1FLT1
SCHEMBL5223934 0.93 ENPP1 (0.60) ENPP1KDREGFRFGFR1FLT1
SCHEMBL1401681 0.92 ENPP1 (0.64) ENPP1KDREGFRFGFR1FLT1
SCHEMBL30408709 0.92 ENPP1 (0.67) ENPP1KDREGFRFGFR1FLT1
SCHEMBL18744742 0.92 ENPP1 (0.67) ENPP1KDREGFRFGFR1FLT1
SCHEMBL4178028 0.92 ENPP1 (0.67) ENPP1KDREGFRFGFR1FLT1
SCHEMBL4379458 0.91 KDR (0.66) ENPP1KDREGFRFGFR1FLT1
Hydrochloric Acid SCHEMBL4373335 0.89 KDR (0.64) ENPP1KDREGFRFGFR1FLT1

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-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
EP-1885719-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2008-02-13 EP disclosed
WO-2006066795-A1 2,5- AND 2,6-DISUBSTITUTED BENZAZOLE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS 4SC AG (DE) 2006-06-29 WO disclosed
US-20060135782-A1 Benzazole analogues and uses thereof 4SC AG (DE) 2006-06-22 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-20060135782-A1 Benzazole analogues and uses thereof DCK, SBK3, DAPK3 ENPP1 1457/4885KDR 1657/4885EGFR 437/4885

“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.