SCHEMBL11295050

SCHEMBL11295050

O=c1[nH]cnc2nc(Cl)cc(Cl)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 5/20 0.49
ALDH1A1 P00352 3/20 0.44
DYRK1A Q13627 3/20 0.41
AURKA O14965 2/20 0.41
DAPK3 O43293 2/20 0.41
PRKD3 O94806 2/20 0.41
MAP4K4 O95819 2/20 0.41
RET P07949 2/20 0.41
IGF1R P08069 2/20 0.41
PIM1 P11309 2/20 0.41
CLK2 P49760 2/20 0.41
GSK3A P49840 2/20 0.41
GSK3B P49841 2/20 0.41
PRKX P51817 2/20 0.41
BTK Q06187 2/20 0.41
TYRO3 Q06418 2/20 0.41
NTRK3 Q16288 2/20 0.41
TAOK1 Q7L7X3 2/20 0.41
CLK4 Q9HAZ1 2/20 0.41
ALK Q9UM73 2/20 0.41

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
SCHEMBL18742201 0.83 PARP1 (0.42) PARP1ALDH1A1PIM1RPS6KA3
SCHEMBL15760950 0.79 PDPK1 (0.40) PARP1ALDH1A1DYRK1APIM1CDK2
SCHEMBL3507178 0.73 DPP4 (0.48) ALDH1A1CDK2POLA1DPP4PNP
SCHEMBL29539126 0.73 DPP4 (0.48) ALDH1A1CDK2POLA1DPP4PNP
SCHEMBL19815527 0.73 PARP1 (0.54) PARP1ALDH1A1DYRK1AAURKADAPK3
SCHEMBL1059900 0.71 PARP1 (0.49) PARP1ALDH1A1PIM1RPS6KA3PIM3
SCHEMBL26155897 0.69 ALDH1A1 (0.50) PARP1ALDH1A1DYRK1AAURKADAPK3
SCHEMBL12962037 0.69 PARP1 (0.46) PARP1ALDH1A1PIM1RPS6KA3ACVR1
SCHEMBL11338486 0.68 JAK2 (0.47) PARP1JAK2RPS6KA3JAK3
SCHEMBL10549158 0.68 PARP1 (0.45) PARP1ALDH1A1KDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4291235-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2023-12-20 EP disclosed
CN-117120090-A HPK1 antagonists and uses thereof 林伯士萨顿公司 2023-11-24 CN disclosed
US-20230096641-A1 HPK1 ANTAGONISTS AND USES THEREOF NIMBUS DISCOVERY, INC. 2023-03-30 US disclosed
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed
WO-2022174253-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. (US) 2022-08-18 WO disclosed
US-20140171429-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-19 US disclosed
US-20140171429-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-19 US disclosed
US-20140171429-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-19 US disclosed
US-20140155389-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-05 US disclosed
US-20140155389-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-05 US disclosed
US-20140155389-A1 BICYCLIC INHIBITORS OF ALK ABBVIE INC. (US) 2014-06-05 US disclosed
EP-2665724-A1 BICYCLIC INHIBITORS OF ALK AbbVie Inc. (US) 2013-11-27 EP disclosed
EP-2665725-A1 BICYCLIC INHIBITORS OF ALK AbbVie Inc. (US) 2013-11-27 EP disclosed
WO-2012097683-A1 BICYCLIC INHIBITORS OF ALK ABBOTT LABORATORIES (US) 2012-07-26 WO disclosed
WO-2012097682-A1 BICYCLIC INHIBITORS OF ALK ABBOTT LABORATORIES (US) 2012-07-26 WO disclosed
WO-2012097683-A1 BICYCLIC INHIBITORS OF ALK ABBOTT LABORATORIES (US) 2012-07-26 WO disclosed
WO-2012097479-A1 BICYCLIC INHIBITORS OF ANAPHASTIC LYMPHOMA KINASE ABBOTT LABORATORIES (US) 2012-07-26 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 (3 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-20140171429-A1 BICYCLIC INHIBITORS OF ALK ALK, ACVR1, ACVR1B PARP1 271/4885ALDH1A1 161/4885DYRK1A 1658/4885
US-20140155389-A1 BICYCLIC INHIBITORS OF ALK ALK, ABL1, BOD1L1 PARP1 260/4885ALDH1A1 140/4885DYRK1A 1404/4885
US-20230096641-A1 HPK1 ANTAGONISTS AND USES THEREOF PDXK, HIPK1, PCK1 PARP1 2477/4885ALDH1A1 4740/4885DYRK1A 860/4885

“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.