SCHEMBL16644581

SCHEMBL16644581

Cc1cn(-c2cc(NC(=O)c3ccc(C)c(C#Cc4cnc5cccnn45)c3)cc(C(F)(F)F)c2)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 19/20 1.00
BCR P11274 4/20 0.69

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
SCHEMBL30011189 1.00 ABL1 (1.00) ABL1BCR
SCHEMBL30788435 0.94 ABL1 (0.88) ABL1
SCHEMBL30788443 0.94 ABL1 (0.88) ABL1
SCHEMBL30788449 0.93 ABL1 (0.87) ABL1BCR
SCHEMBL15442784 0.93 ABL1 (0.87) ABL1BCR
SCHEMBL24123159 0.92 ABL1 (1.00) ABL1BCR
SCHEMBL30011770 0.92 ABL1 (1.00) ABL1
SCHEMBL24123283 0.92 ABL1 (1.00) ABL1BCR
SCHEMBL30011137 0.92 ABL1 (1.00) ABL1BCR
SCHEMBL30010951 0.92 ABL1 (1.00) ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250368655-A1 SMALL MOLECULE INHIBITORS OF BCR-ABL OREGON HEALTH & SCIENCE UNIVERSITY (US) 2025-12-04 US disclosed
US-20240199626-A1 COMPOUNDS WITH IMPROVED CARDIAC SAFETY FOR THE TREATMENT OF CANCER AND NEURODEGENERATIVE DISORDERS OREGON HEALTH & SCIENCE UNIVERSITY (US) 2024-06-20 US disclosed
EP-4326269-A1 COMPOUNDS WITH IMPROVED CARDIAC SAFETY FOR THE TREATMENT OF CANCER AND NEURODEGENERATIVE DISORDERS Oregon Health & Science University (US) 2024-02-28 EP disclosed
US-20210393628-A1 COMPOSITIONS AND METHODS FOR MODULATING T CELL EXHAUSTION THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2021-12-23 US disclosed
US-9722188-B2 Material for organic electronic device, and organic electronic device using the same LG CHEM, LTD. (KR) 2017-08-01 US disclosed
US-20150105377-A1 Methods and Compositions for RAF Kinase Mediated Diseases ARIAD PHARMACEUTICALS, INC. 2015-04-16 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 (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-20240199626-A1 COMPOUNDS WITH IMPROVED CARDIAC SAFETY FOR THE TREATMENT OF CANCER AND NEURODEGENERATIVE DISORDERS SMN1; SMN2, MCL1, NLN ABL1 76/4885BCR 56/4885
US-20150105377-A1 Methods and Compositions for RAF Kinase Mediated Diseases BRAF, RAF1, NRAS ABL1 75/4885BCR 298/4885
US-20250368655-A1 SMALL MOLECULE INHIBITORS OF BCR-ABL ABL1, BCR, LTK ABL1 1/4885BCR 2/4885
US-20210393628-A1 COMPOSITIONS AND METHODS FOR MODULATING T CELL EXHAUSTION CD4, ICOS, NFATC1 ABL1 237/4885BCR 357/4885

“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.