SCHEMBL8536228

SCHEMBL8536228

CNC(=O)CCc1cc(-c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)n(-c2ccc(N3CCNCC3)cc2)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ILK Q13418 1/20 1.00
ALOX5 P09917 9/20 0.50
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46
KCNH2 Q12809 2/20 0.44
P2RY14 Q15391 1/20 0.43
MAPKAPK2 P49137 1/20 0.42
CYP2C9 P11712 1/20 0.42
EPHX2 P34913 2/20 0.41
MAOB P27338 1/20 0.41
PTGS2 P35354 1/20 0.41
AKR1C3 P42330 1/20 0.41
CHRNA7 P36544 1/20 0.41
PTGS1 P23219 1/20 0.40

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
SCHEMBL8612124 0.91 ILK (0.84) ILKALOX5RXRARXRBRXRG
SCHEMBL9104641 0.89 ILK (0.80) ILKALOX5RXRARXRBRXRG
SCHEMBL9103873 0.89 ILK (0.80) ILKALOX5RXRARXRBRXRG
SCHEMBL9102839 0.86 ILK (0.76) ILKRXRARXRBRXRGMAPKAPK2
SCHEMBL17077247 0.86 ILK (0.75) ILKALOX5RXRARXRBRXRG
SCHEMBL17087637 0.85 ILK (0.74) ILKALOX5RXRARXRBRXRG
SCHEMBL15560693 0.85 ILK (0.74) ILKALOX5RXRARXRBRXRG
SCHEMBL29694581 0.85 ILK (0.73) ILKP2RY14MAPKAPK2MAOBPTGS2
SCHEMBL17077245 0.83 ILK (0.70) ILKALOX5RXRARXRBRXRG
SCHEMBL17087661 0.82 ILK (0.70) ILKALOX5RXRARXRBRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4662319-A2 PERSONALIZED CRISPR PROFILING FOR CANCER Integrate Bioscience LLC (US) 2025-12-17 EP disclosed
WO-2025053613-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING PERIPHERAL NERVE TUMOR COMPRISING ILK INHIBITOR AND USE THEREOF 재단법인 아산사회복지재단 2025-03-13 WO disclosed
WO-2024168301-A2 PERSONALIZED CRISPR PROFILING FOR CANCER FUNCTION ONCOLOGY, INC. (US) 2024-08-15 WO disclosed
US-20230127636-A1 COMPOUNDS FOR TREATING ILK-MEDIATED DISEASES THE CLEVELAND CLINIC FOUNDATION 2023-04-27 US disclosed
US-20230127636-A1 COMPOUNDS FOR TREATING ILK-MEDIATED DISEASES THE CLEVELAND CLINIC FOUNDATION 2023-04-27 US disclosed
US-11524945-B2 Compounds for treating ILK-mediated diseases THE CLEVELAND CLINIC FOUNDATION (US) 2022-12-13 US disclosed
CN-114617886-A Antibacterial use of compounds and pharmaceutically acceptable salts thereof 中国医学科学院医药生物技术研究所 2022-06-14 CN disclosed
US-20210114993-A1 COMPOUNDS FOR TREATING ILK-MEDIATED DISEASES THE CLEVELAND CLINIC FOUNDATION 2021-04-22 US disclosed
EP-2642856-B1 INTEGRIN-LINKED KINASE INHIBITORS UNIV OHIO STATE RES FOUND (US) 2017-07-19 EP disclosed
US-8658647-B2 Integrin-linked kinase inhibitors THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2014-02-25 US disclosed
EP-2642856-A1 INTEGRIN-LINKED KINASE INHIBITORS The Ohio State University Research Foundation (US) 2013-10-02 EP disclosed
CN-103298344-A Integrin-linked kinase inhibitors UNIV OHIO STATE RES FOUND 2013-09-11 CN disclosed
US-20120142702-A1 INTEGRIN-LINKED KINASE INHIBITORS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2012-06-07 US disclosed
WO-2012071310-A1 INTEGRIN-LINKED KINASE INHIBITORS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2012-05-31 WO 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 (4 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-20210114993-A1 COMPOUNDS FOR TREATING ILK-MEDIATED DISEASES ILK, ITGB1, ITGA2B ILK 1/4885ALOX5 3182/4885RXRA 2980/4885
US-20230127636-A1 COMPOUNDS FOR TREATING ILK-MEDIATED DISEASES ILK, ITGB1, ITGA2B ILK 1/4885ALOX5 3182/4885RXRA 2980/4885
US-20120142702-A1 INTEGRIN-LINKED KINASE INHIBITORS PTK2, ITGB1, ITGB2 ILK 8/4885ALOX5 3094/4885RXRA 3080/4885
US-11524945-B2 Compounds for treating ILK-mediated diseases ILK, ITGB1, ITGA2B ILK 1/4885ALOX5 3182/4885RXRA 2980/4885

“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.