SCHEMBL29576142

SCHEMBL29576142

c1ccc2nc(Nc3ccc(-c4cn[nH]c4)cc3)ncc2c1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 3/20 0.59
ROCK1 Q13464 1/20 0.55
MAP4K1 Q92918 2/20 0.53
JUN P05412 2/20 0.49
MAPK10 P53779 2/20 0.49
MAPK8 P45983 1/20 0.48
ROCK2 O75116 6/20 0.47
AKT1 P31749 1/20 0.46
AKT2 P31751 1/20 0.46
PLK1 P53350 1/20 0.46
ALK Q9UM73 1/20 0.45
ILK Q13418 1/20 0.43
BRAF P15056 1/20 0.42

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
Benzene SCHEMBL28188863 0.77 MAP3K5 (0.60) MAP3K5ROCK1MAPK8
SCHEMBL31381352 0.77 MAP3K5 (0.60) MAP3K5ROCK1MAPK8
SCHEMBL167891 0.77 MAP3K5 (0.60) MAP3K5ROCK1MAPK8
SCHEMBL27770482 0.77 MAP3K5 (0.60) MAP3K5ROCK1MAPK8
SCHEMBL4573935 0.76 MAP3K5 (0.58) MAP3K5ROCK1MAPK8
Hydrochloric Acid SCHEMBL8807679 0.76 MAP3K5 (0.58) MAP3K5ROCK1MAPK8
Hydrochloric Acid SCHEMBL8810105 0.76 ROCK1 (0.52) MAP3K5ROCK1MAP4K1MAPK8BRAF
SCHEMBL1632143 0.75 MAP4K1 (0.58) MAP3K5MAP4K1JUNMAPK10MAPK8
SCHEMBL30512124 0.75 MAP4K1 (0.61) MAP3K5MAP4K1JUNMAPK10MAPK8
SCHEMBL30512106 0.75 MAP3K5 (0.61) MAP3K5MAP4K1JUNMAPK10MAPK8

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-20260102406-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA INC (US) 2026-04-16 US disclosed
US-12403145-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC (US) 2025-09-02 US disclosed
US-20240197752-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA INC 2024-06-20 US disclosed
US-11865120-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2024-01-09 US disclosed
US-20220354864-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY NEUPHARMA, INC. 2022-11-10 US disclosed
US-11304957-B2 Substituted quinazolines for inhibiting kinase activity NEUPHARMA, INC. (US) 2022-04-19 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 (6 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-20240197752-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY DCK, ABL1, MAP4K2 MAP3K5 8/4885ROCK1 544/4885MAP4K1 16/4885
US-11865120-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 MAP3K5 8/4885ROCK1 544/4885MAP4K1 16/4885
US-12403145-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 MAP3K5 8/4885ROCK1 544/4885MAP4K1 16/4885
US-11304957-B2 Substituted quinazolines for inhibiting kinase activity DCK, ABL1, MAP4K2 MAP3K5 8/4885ROCK1 544/4885MAP4K1 16/4885
US-20220354864-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY DCK, ABL1, MAP4K2 MAP3K5 8/4885ROCK1 544/4885MAP4K1 16/4885
US-20260102406-A1 SUBSTITUTED QUINAZOLINES FOR INHIBITING KINASE ACTIVITY BRAF, TTK, MAP4K2 MAP3K5 35/4885ROCK1 693/4885MAP4K1 25/4885

“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.