SCHEMBL31367564

SCHEMBL31367564

NC(=O)c1cccc(-c2cn3cc(-c4ccccc4)cc(-c4ccccc4)c3n2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.52
TMIGD3 P0DMS9 4/20 0.47
ADORA3 P0DMS8 3/20 0.47
ALDH1A2 O94788 2/20 0.45
ALDH1A3 P47895 2/20 0.45
ALDH1A1 P00352 1/20 0.44
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
DHODH Q02127 3/20 0.43
SYK P43405 2/20 0.43
CHEK2 O96017 2/20 0.43
DYRK1A Q13627 2/20 0.43
CDC7 O00311 1/20 0.43
PLK4 O00444 1/20 0.43
CHEK1 O14757 1/20 0.43
AURKA O14965 1/20 0.43
MAPK13 O15264 1/20 0.43
PDPK1 O15530 1/20 0.43
DYRK3 O43781 1/20 0.43
ROCK2 O75116 1/20 0.43

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
SCHEMBL31367611 0.96 NR4A2 (0.54) NR4A2TMIGD3ADORA3ALDH1A2ALDH1A3
SCHEMBL31367545 0.96 NR4A2 (0.57) NR4A2TMIGD3ADORA3ALDH1A2ALDH1A3
SCHEMBL31367521 0.90 ALDH1A3 (0.52) NR4A2TMIGD3ADORA3ALDH1A2ALDH1A3
SCHEMBL31367461 0.90 ALDH1A3 (0.52) NR4A2TMIGD3ADORA3ALDH1A2ALDH1A3
SCHEMBL31367450 0.90 ALDH1A3 (0.52) NR4A2TMIGD3ADORA3ALDH1A2ALDH1A3
SCHEMBL31367612 0.82 BCAT2 (0.55) TMIGD3ADORA3ALDH1A2ALDH1A3ALDH1A1
SCHEMBL31367607 0.82 ALDH1A3 (0.63) TMIGD3ADORA3ALDH1A2ALDH1A3ALDH1A1
SCHEMBL31367623 0.82 MAPT (0.52) ALDH1A2ALDH1A3ALDH1A1ADORA2AADORA1
SCHEMBL31367554 0.82 ALDH1A3 (0.49) ADORA3ALDH1A2ALDH1A3ALDH1A1ADORA2A
SCHEMBL31367509 0.81 BCAT2 (0.56) TMIGD3ADORA3ALDH1A2ALDH1A3ALDH1A1

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
EP-4735442-A1 IMIDAZO[1,2-alpha]PYRIDINE COMPOUNDS FOR USE IN TREATING CANCER AND INFLAMMATORY DISEASES AND METHODS TO PREPARE SAID COMPOUNDS Theranib Inc. (CA) 2026-05-06 EP claimed
US-20250011322-A1 MEDICAL COMPOUND FOR THE INHIBITION OF ALDEHYDE DEHYDROGENASE SUBTYPE 1A THERANIB INC. (CA) 2025-01-09 US claimed
EP-4735442-A1 IMIDAZO[1,2-alpha]PYRIDINE COMPOUNDS FOR USE IN TREATING CANCER AND INFLAMMATORY DISEASES AND METHODS TO PREPARE SAID COMPOUNDS Theranib Inc. (CA) 2026-05-06 EP disclosed
US-20250011322-A1 MEDICAL COMPOUND FOR THE INHIBITION OF ALDEHYDE DEHYDROGENASE SUBTYPE 1A THERANIB INC. (CA) 2025-01-09 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-20250011322-A1 MEDICAL COMPOUND FOR THE INHIBITION OF ALDEHYDE DEHYDROGENASE SUBTYPE 1A ALDH2, ALDH3A1, ALDH1A1 NR4A2 841/4885TMIGD3 2337/4885ADORA3 2130/4885

“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.