SCHEMBL18335769

SCHEMBL18335769

Cc1nc2ccc(Br)nc2c(=O)n1C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PARG Q86W56 1/20 0.39
▸ KDM4E B2RXH2 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ LMNA P02545 1/20 0.35
▸ HCAR1 Q9BXC0 3/20 0.34
▸ EGFR P00533 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ MAPT P10636 2/20 0.32
▸ ATM Q13315 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL18336768 0.79 KDM4E (0.39) KDM4EALDH1A1LMNAMAPTATM
SCHEMBL18336468 0.79 AADAT (0.41) KDM4EALDH1A1LMNAMAPTMEN1
SCHEMBL18336161 0.78 AADAT (0.41) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL18337338 0.74 AADAT (0.45) LMNACDK9DYRK1AMEN1KMT2A
SCHEMBL31586908 0.74 DYRK1A (0.50) KDM4EALDH1A1LMNAHCAR1CDK9
SCHEMBL19699620 0.72 NPSR1 (0.46) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL31751270 0.71 KDM4E (0.47) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL9919073 0.71 CASP3 (0.54) PARGLMNAMAPTATMMEN1
SCHEMBL25169153 0.68 EGFR (0.42) PARGKDM4EALDH1A1LMNAEGFR
SCHEMBL1161500 0.68 CASP3 (0.43) PARGKDM4EALDH1A1LMNAMAPT

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-3683222-B1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2021-10-06 — — EP disclosed
EP-3683222-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2020-07-22 — — EP disclosed
US-10065972-B2 Bicyclic or tricyclic heterocyclic compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-09-04 — — US disclosed
EP-3135674-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2017-03-01 — — EP disclosed
US-20160376289-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-29 — — US disclosed
US-20160376289-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2016-12-29 — — 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 (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-20160376289-A1 NOVEL BICYCLIC OR TRICYCLIC HETEROCYCLIC COMPOUND CBR3, CBR1, CYCS PARG 4216/4885KDM4E 2147/4885ALDH1A1 2826/4885
US-10065972-B2 Bicyclic or tricyclic heterocyclic compound CBR3, CBR1, CYCS PARG 3810/4885KDM4E 2297/4885ALDH1A1 3047/4885

“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.

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