SCHEMBL20489690

SCHEMBL20489690

CCOc1cnc2nc(Cl)sc2n1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 1/20 0.39
AADAT Q8N5Z0 1/20 0.38
CCR4 P51679 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
PI4KA P42356 1/20 0.31
PIK3CG P48736 1/20 0.31
PI4KB Q9UBF8 1/20 0.31
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL31229328 0.80 PIK3CD (0.42) ALDH1A1KMT2AAADATPIK3CDPIK3CA
SCHEMBL20489475 0.80 PIK3CD (0.42) ALDH1A1KMT2AAADATPIK3CDPIK3CA
SCHEMBL20489611 0.76 AADAT (0.35) ALDH1A1KMT2AAADAT
SCHEMBL20489574 0.73 AADAT (0.45) ALDH1A1AADATKDM4ESMN1; SMN2
SCHEMBL20489583 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL2310243 0.69 MAPK1 (0.32)
SCHEMBL29813863 0.69 CKS1B (0.35) KMT2AAADAT
SCHEMBL20489525 0.69 CKS1B (0.35) KMT2AAADAT
SCHEMBL13064465 0.67 HRH4 (0.49) ALDH1A1KMT2APIK3CGKDM4ESMN1; SMN2
SCHEMBL1697997 0.65 MEN1 (0.42) ALDH1A1KMT2AAADATPIK3CDPIK3CA

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
EP-3372601-B1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2022-09-21 EP disclosed
US-10793582-B2 Bicyclic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2020-10-06 US disclosed
US-10793582-B2 Bicyclic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2020-10-06 US disclosed
US-20190233438-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-08-01 US disclosed
US-20190233438-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-08-01 US disclosed
EP-3372601-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2018-09-12 EP 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 (2 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-20190233438-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND KAT2A, KAT7, KAT5 ALDH1A1 2879/4885KMT2A 91/4885AADAT 1539/4885
US-10793582-B2 Bicyclic heterocyclic compound KAT2A, KAT7, KAT5 ALDH1A1 2375/4885KMT2A 80/4885AADAT 1329/4885

“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.