SCHEMBL6642498

SCHEMBL6642498

N#Cc1cnc2cnc(Cl)cc2c1Cl

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CSNK1A1 P48729 1/20 0.37
▸ CLK4 Q9HAZ1 1/20 0.37
▸ SRC P12931 13/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ ABL1 P00519 2/20 0.34
▸ BCR P11274 2/20 0.34
▸ EGFR P00533 2/20 0.33
▸ ERBB2 P04626 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ MAP3K8 P41279 1/20 0.32

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
SCHEMBL867875 0.83 CYP11B2 (0.42) CSNK1A1CLK4SRCCHRM4EGFR
SCHEMBL6642503 0.83 EGFR (0.40) CSNK1A1CLK4SRCCHRM4ABL1
SCHEMBL30083634 0.83 EGFR (0.40) CSNK1A1CLK4SRCCHRM4ABL1
SCHEMBL20770813 0.79 SRC (0.42) SRCABL1BCREGFRERBB2
SCHEMBL15150207 0.77 SRC (0.42) SRCABL1BCREGFRERBB2
SCHEMBL19877265 0.77 SRC (0.47) SRCCHRM4ABL1BCREGFR
SCHEMBL15263291 0.77 SRC (0.41) CSNK1A1CLK4SRCCHRM4ABL1
SCHEMBL6641411 0.76 SRC (0.33) CSNK1A1CLK4SRCABL1BCR
SCHEMBL24010609 0.75 CHRM4 (0.45) SRCCHRM4ABL1BCREGFR
SCHEMBL12928111 0.75 SRC (0.38) CSNK1A1CLK4SRCCHRM4ABL1

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
WO-2022266425-A1 3-CYANO-QUINOLINE DERIVATIVES AND USES THEREOF BLACK DIAMOND THERAPEUTICS, INC. (US) 2022-12-22 — — WO disclosed
EP-1171440-B1 SUBSTITUTED-3-CYANO-[1.7],[1.5], AND [1.8]-NAPHTHYRIDINE INHIBITORS OF TYROSINE KINASES WYETH CORP (US) 2004-04-14 — — EP disclosed
US-6548496-B2 Anticancer agents AMERICAN CYANAMID COMPANY 2003-04-15 — — US disclosed
US-20020165229-A1 Substituted 3-cyano-[1.7], [1.5], and [1.8] naphthyridine inhibitors of tyrosine kinases AMERICAN CYANAMID COMPANY 2002-11-07 — — US disclosed
US-6355636-B1 ENZYME INHIBITORS AMERICAN CYANAMID COMPANY 2002-03-12 — — 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-20020165229-A1 Substituted 3-cyano-[1.7], [1.5], and [1.8] naphthyridine inhibitors of tyrosine kinases ABL1, ROS1, ALK CSNK1A1 27/4885CLK4 868/4885SRC 10/4885

“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.

Send feedback