SCHEMBL29758552

SCHEMBL29758552

Oc1cccc(Nc2ccnc3[nH]c4ccccc4c23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTK6 Q13882 14/20 1.00
ERBB2 P04626 7/20 1.00
AURKA O14965 2/20 1.00
EGFR P00533 1/20 1.00
SRC P12931 1/20 1.00
ACVR1 Q04771 1/20 1.00
ALK Q9UM73 1/20 1.00
AURKC Q9UQB9 1/20 1.00

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
SCHEMBL25096205 1.00 PTK6 (1.00) PTK6ERBB2AURKAEGFRSRC
SCHEMBL684772 0.83 PTK6 (0.71) PTK6ERBB2AURKAEGFRSRC
SCHEMBL675375 0.81 PTK6 (0.79) PTK6ERBB2AURKAEGFRSRC
SCHEMBL675486 0.80 PTK6 (1.00) PTK6ERBB2AURKAEGFRSRC
SCHEMBL4882303 0.76 EGFR (0.69) PTK6ERBB2AURKAEGFRSRC
SCHEMBL16024047 0.76 ERBB2 (0.61) PTK6ERBB2AURKAEGFRSRC
SCHEMBL858313 0.74 TTBK1 (0.63) PTK6ERBB2AURKAEGFRSRC
SCHEMBL13461148 0.72 ERBB2 (0.70) PTK6ERBB2AURKAEGFRSRC
SCHEMBL6522191 0.72 PTK6 (0.77) PTK6ERBB2AURKAEGFRSRC
SCHEMBL6521467 0.72 AURKA (0.74) PTK6ERBB2AURKAEGFRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119889425-A PTK6/hnRNPH1/NBR 1-based computer-aided drug screening method, system and device 徐州医科大学附属医院 2025-04-25 CN claimed
US-20240358678-A1 METHODS AND COMPOSITIONS FOR ENHANCING CHEMOTHERAPEUTIC DRUG UPTAKE INTO BRAIN TUMORS BROWN UNIVERSITY 2024-10-31 US claimed
WO-2026102161-A1 METHODS OF TREATING OVARIAN AND PANCREATIC CANCER CONCARLO THERAPEUTICS, INC. (US) 2026-05-15 WO disclosed
EP-4712963-A2 SMALL MOLECULE INHIBITORS OF P27 Concarlo Therapeutics, Inc. (US) 2026-03-25 EP disclosed
US-20250262268-A1 Methods and Compositions for Inhibiting Viral Infection NEW YORK UNIVERSITY 2025-08-21 US disclosed
CN-119889425-A PTK6/hnRNPH1/NBR 1-based computer-aided drug screening method, system and device 徐州医科大学附属医院 2025-04-25 CN disclosed
CN-113329749-B Combination therapy for the treatment of uveal melanoma 伊利诺伊大学董事会 2025-02-11 CN disclosed
EP-3852744-B1 COMBINATION THERAPY FOR THE TREATMENT OF UVEAL MELANOMA UNIV ILLINOIS (US) 2024-12-04 EP disclosed
WO-2024238709-A2 SMALL MOLECULE INHIBITORS OF P27 CONCARLO THERAPEUTICS, INC. (US) 2024-11-21 WO disclosed
US-20240358678-A1 METHODS AND COMPOSITIONS FOR ENHANCING CHEMOTHERAPEUTIC DRUG UPTAKE INTO BRAIN TUMORS BROWN UNIVERSITY 2024-10-31 US disclosed
US-12090153-B2 Combination therapy for the treatment of uveal melanoma THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-09-17 US disclosed
US-11384150-B2 Antibody-drug conjugates and uses thereof DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2022-07-12 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 (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-20240358678-A1 METHODS AND COMPOSITIONS FOR ENHANCING CHEMOTHERAPEUTIC DRUG UPTAKE INTO BRAIN TUMORS SLC19A1, SLC5A7, FABP7 PTK6 3533/4885ERBB2 807/4885AURKA 1446/4885
US-11384150-B2 Antibody-drug conjugates and uses thereof EGFR, ERBB2, ERBB3 PTK6 24/4885ERBB2 2/4885AURKA 97/4885
US-12090153-B2 Combination therapy for the treatment of uveal melanoma GNAQ, GNA11, GNB1 PTK6 1388/4885ERBB2 1648/4885AURKA 743/4885

“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.