SCHEMBL4791894

SCHEMBL4791894

Cc1ccc(-c2ccnc3[nH]ccc23)s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 3/20 0.53
ROCK1 Q13464 2/20 0.53
IKBKB O14920 1/20 0.53
CHUK O15111 1/20 0.53
DAPK3 O43293 1/20 0.53
JAK2 O60674 1/20 0.53
PRKD3 O94806 1/20 0.53
MAP4K4 O95819 1/20 0.53
PAK4 O96013 1/20 0.53
CSF1R P07333 1/20 0.53
RET P07949 1/20 0.53
IGF1R P08069 1/20 0.53
FGFR1 P11362 1/20 0.53
PRKACA P17612 1/20 0.53
FLT1 P17948 1/20 0.53
LTK P29376 1/20 0.53
GRK5 P34947 1/20 0.53
KDR P35968 1/20 0.53
MAP2K2 P36507 1/20 0.53
MAPK8 P45983 1/20 0.53

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
SCHEMBL31690444 1.00 AURKB (0.53) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL2239821 0.83 PRKCI (0.53) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL103099 0.80 IKBKB (0.69) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL29541343 0.80 IKBKB (0.69) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL4791074 0.80 AKT1 (0.58) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL1718381 0.79 JAK3 (0.48) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL2240671 0.78 AURKB (0.71) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL8239427 0.78 AKT1 (0.62) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL10124969 0.78 AKT1 (0.62) AURKBROCK1IKBKBCHUKDAPK3
SCHEMBL30173287 0.77 AXL (0.58) AURKBROCK1JAK2RPS6KA3JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1979353-A2 FUSED HETEROBICYCLIC KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2008-10-15 EP claimed
US-20070208053-A1 Fused heterobicyclic kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-09-06 US claimed
WO-2007084667-A2 FUSED HETEROBICYCLIC KINASE INHIBITORS OSI PHARMACEUTICAL, INC. (US) 2007-07-26 WO claimed
WO-2024111671-A1 NUCLEIC ACID APTAMER ゼノリス プライベート リミテッド 2024-05-30 WO disclosed
EP-1881983-B1 PYRROLOPYRIDINES USEFUL AS INHIBITORS OF PROTEIN KINASE VERTEX PHARMA (US) 2012-01-11 EP disclosed
US-20070208053-A1 Fused heterobicyclic kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-09-06 US disclosed
US-20070208053-A1 Fused heterobicyclic kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-09-06 US disclosed
US-20070208053-A1 Fused heterobicyclic kinase inhibitors OSI PHARMACEUTICALS, INC. 2007-09-06 US disclosed
WO-2007084667-A2 FUSED HETEROBICYCLIC KINASE INHIBITORS OSI PHARMACEUTICAL, INC. (US) 2007-07-26 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 (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-20070208053-A1 Fused heterobicyclic kinase inhibitors MAP2K5, MAP2K7, MAP2K2 AURKB 394/4885ROCK1 560/4885IKBKB 138/4885

“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.