SCHEMBL15550320

SCHEMBL15550320

CC(N)c1cc2ncc(Cl)n2c(=O)n1-c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.34
GSK3A P49840 2/20 0.34
MAT2A P31153 5/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
PIK3CD O00329 5/20 0.32
PIK3R2 O00459 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
KMT2A Q03164 1/20 0.32
PIK3CG P48736 2/20 0.32
PIK3R1 P27986 3/20 0.31
PDE11A Q9HCR9 1/20 0.31

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
SCHEMBL15598610 1.00 GSK3B (0.34) GSK3BGSK3AMAT2AALDH1A1GAA
SCHEMBL15598613 1.00 GSK3B (0.34) GSK3BGSK3AMAT2AALDH1A1GAA
SCHEMBL15598612 0.90 KDM4E (0.39) GSK3BGSK3AMAT2AALDH1A1GAA
SCHEMBL15558529 0.87 COMT (0.36) GSK3BGSK3AMAT2AALDH1A1GAA
SCHEMBL15559495 0.81 ALDH1A1 (0.39) GSK3BGSK3AMAT2AALDH1A1NPC1
SCHEMBL15559028 0.81 GSK3A (0.30) GSK3BGSK3APDE11A
SCHEMBL17986919 0.78 PIK3CD (0.31) GSK3BPIK3CDPIK3CGPIK3R1
SCHEMBL17657955 0.77 GSK3A (0.37) GSK3BGSK3AMAT2AGAANPC1
SCHEMBL17174856 0.77 PIK3CD (0.42) PIK3CDPIK3R2PIK3CGPIK3R1
SCHEMBL15549142 0.76 KMT2A (0.38) GSK3BGSK3AMAT2AALDH1A1NPC1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10941162-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2021-03-09 US disclosed
US-10919914-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2021-02-16 US disclosed
US-20190330240-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF TWELVE THERAPEUTICS, INC. 2019-10-31 US disclosed
US-20190135833-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF TWELVE THERAPEUTICS, INC. 2019-05-09 US disclosed
US-10253047-B2 Heterocyclic compounds and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2019-04-09 US disclosed
US-20170369511-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF TWELVE THERAPEUTICS, INC. 2017-12-28 US disclosed
US-9708348-B2 Trisubstituted bicyclic heterocyclic compounds with kinase activities and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2017-07-18 US disclosed
US-9708348-B2 Trisubstituted bicyclic heterocyclic compounds with kinase activities and uses thereof INFINITY PHARMACEUTICALS, INC. (US) 2017-07-18 US disclosed
US-20160122365-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF TWELVE THERAPEUTICS, INC. 2016-05-05 US disclosed
US-20150307520-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS THEREOF HUTCHISON MEDIPHARMA LTD (CN) 2015-10-29 US disclosed
US-20150291593-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LTD (CN) 2015-10-15 US disclosed
US-20150291593-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LTD (CN) 2015-10-15 US disclosed
US-20150291593-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LTD (CN) 2015-10-15 US disclosed
EP-2877472-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITION AND METHODS THEREOF Hutchison Medipharma Limited (CN) 2015-06-03 EP disclosed
WO-2014015830-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITION AND METHODS THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2014-01-30 WO disclosed
WO-2014015830-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITION AND METHODS THEREOF HUTCHISON MEDIPHARMA LIMITED (CN) 2014-01-30 WO disclosed
WO-2014015523-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LIMITED (CN) 2014-01-30 WO disclosed
WO-2014015523-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LIMITED (CN) 2014-01-30 WO disclosed
WO-2014015675-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LIMITED (CN) 2014-01-30 WO disclosed
WO-2014015675-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS HUTCHISON MEDIPHARMA LIMITED (CN) 2014-01-30 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 (9 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-10919914-B2 Heterocyclic compounds and uses thereof PIK3CA, PIK3CD, PIK3CB GSK3B 92/4885GSK3A 82/4885MAT2A 2283/4885
US-20150307520-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS THEREOF PIK3C3, PIK3C2B, PIK3C2A GSK3B 116/4885GSK3A 161/4885MAT2A 2937/4885
US-20170369511-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB GSK3B 92/4885GSK3A 82/4885MAT2A 2283/4885
US-20190135833-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB GSK3B 92/4885GSK3A 82/4885MAT2A 2283/4885
US-20160122365-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB GSK3B 92/4885GSK3A 82/4885MAT2A 2283/4885
US-20150291593-A1 NOVEL HETEROARYL AND HETEROCYCLE COMPOUNDS, COMPOSITIONS AND METHODS PIK3C2B, PIK3C3, PIK3C2A GSK3B 79/4885GSK3A 119/4885MAT2A 3168/4885
US-10941162-B2 Heterocyclic compounds and uses thereof PIK3CA, PIK3CD, PIK3CB GSK3B 121/4885GSK3A 143/4885MAT2A 2211/4885
US-20190330240-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB GSK3B 92/4885GSK3A 82/4885MAT2A 2283/4885
US-10253047-B2 Heterocyclic compounds and uses thereof PIK3CA, PIK3CD, PIK3CB GSK3B 101/4885GSK3A 105/4885MAT2A 3673/4885

“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.