SCHEMBL6164562

SCHEMBL6164562

CN(C)Cc1cnnn1-c1cccc(C(=O)CC(=O)Nc2cc(Cl)c(N(C)C)cc2NC(=O)OC(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.39
MALT1 Q9UDY8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
APOBEC3A P31941 1/20 0.31
CASP7 P55210 1/20 0.31
CASP6 P55212 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL6168329 0.91 HSD11B1 (0.37) HSD11B1MALT1
SCHEMBL6162617 0.90 HSD11B1 (0.36) HSD11B1MALT1L3MBTL1
SCHEMBL6607778 0.89 HSD11B1 (0.44) HSD11B1MALT1APOBEC3ACASP7CASP6
SCHEMBL6165821 0.85 HSD11B1 (0.33) HSD11B1
SCHEMBL28745485 0.85 HSD11B1 (0.36) HSD11B1MALT1
SCHEMBL6166386 0.83 NOTUM (0.38) SMN1; SMN2APOBEC3ACASP7CASP6APOBEC3G
SCHEMBL6166534 0.80 KAT6A (0.35) APOBEC3ACASP7CASP6APOBEC3GTDP1
SCHEMBL6164841 0.80 EP300 (0.32) HSD11B1
SCHEMBL6164798 0.80 RAB9A (0.38) APOBEC3ACASP7CASP6APOBEC3GTDP1
SCHEMBL6434107 0.80 PLOD2 (0.36) SMN1; SMN2TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1379511-B1 DIHYDRO-BENZO (b) (1, 4) DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II HOFFMANN LA ROCHE (CH) 2005-07-20 EP disclosed
US-6544985-B2 For therapy of acute and/or chronic neurological disorders such as psychosis, schizophrenia, Alzheimer's disease, cognitive disorders and memory deficits HOFFMAN-LA ROCHE INC. 2003-04-08 US disclosed
US-20020193367-A1 Dihydro-benzo [b] [1,4] diazepin-2-one derivatives F. HOFFMAN-LA ROCHE AG A SWISS COMPANY (CH) 2002-12-19 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 (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-20020193367-A1 Dihydro-benzo [b] [1,4] diazepin-2-one derivatives CYP1B1, GRIN2B, BDKRB1 HSD11B1 175/4885MALT1 3324/4885SMN1; SMN2 528/4885

“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.