SCHEMBL6501763

SCHEMBL6501763

CN(C)c1ccc(NC2=C(Cl)C(=O)c3ccccc3C2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 1.00
▸ HTT P42858 11/20 1.00
▸ RAB9A P51151 10/20 1.00
▸ KMT2A Q03164 10/20 1.00
▸ NPSR1 Q6W5P4 8/20 1.00
▸ MEN1 O00255 8/20 1.00
▸ MAPK1 P28482 8/20 1.00
▸ ALDH1A1 P00352 7/20 1.00
▸ GAA P10253 5/20 1.00
▸ L3MBTL1 Q9Y468 5/20 1.00
▸ LMNA P02545 5/20 1.00
▸ TDP1 Q9NUW8 5/20 1.00
▸ HPGD P15428 4/20 1.00
▸ SMN1; SMN2 Q16637 3/20 1.00
▸ NSD2 O96028 2/20 1.00
▸ GALR2 O43603 1/20 1.00
▸ NPC1 O15118 7/20 0.72
▸ ATM Q13315 5/20 0.72
▸ MCL1 Q07820 4/20 0.72
▸ KDM4E B2RXH2 3/20 0.72

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
SCHEMBL4868219 0.82 MAPT (1.00) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL32664539 0.82 MAPT (0.79) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL29633261 0.81 MAPT (1.00) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL6506683 0.81 MAPT (1.00) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL6509081 0.80 MAPT (0.66) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL12283294 0.79 MAPT (0.71) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL7240445 0.79 MAPT (0.74) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL8663288 0.79 MAPT (0.74) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL4873496 0.79 MAPT (1.00) MAPTHTTRAB9AKMT2ANPSR1
SCHEMBL12283051 0.78 MAPT (0.72) MAPTHTTRAB9AKMT2ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9272993-B2 Naphthoquinone derivatives useful for prevention of amyloid deposits and treatment of diseases involving amyloidogenesis RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2016-03-01 — — US disclosed
US-9272993-B2 Naphthoquinone derivatives useful for prevention of amyloid deposits and treatment of diseases involving amyloidogenesis RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2016-03-01 — — US disclosed
US-20140213627-A1 NAPHTHOQUINONE DERIVATIVES USEFUL FOR PREVENTION OF AMYLOID DEPOSITS AND TREATMENT OF DISEASES INVOLVING AMYLOIDOGENESIS RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2014-07-31 — — US disclosed
US-20140213627-A1 NAPHTHOQUINONE DERIVATIVES USEFUL FOR PREVENTION OF AMYLOID DEPOSITS AND TREATMENT OF DISEASES INVOLVING AMYLOIDOGENESIS RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2014-07-31 — — US disclosed
US-20110224184-A1 NAPHTHOQUINONE DERIVATIVES USEFUL FOR PREVENTION OF AMYLOID DEPOSITS AND TREATMENT OF DISEASES INVOLVING AMYLOIDOGENESIS RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2011-09-15 — — US disclosed
US-20110224184-A1 NAPHTHOQUINONE DERIVATIVES USEFUL FOR PREVENTION OF AMYLOID DEPOSITS AND TREATMENT OF DISEASES INVOLVING AMYLOIDOGENESIS RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2011-09-15 — — US disclosed
WO-2010026592-A1 NAPHTHOQUINONE DERIVATIVES USEFUL FOR PREVENTION OF AMYLOID DEPOSITS AND TREATMENT OF DISEASES INVOLVING AMYLOIDOGENESIS RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2010-03-11 — — WO disclosed
US-20050032794-A1 Diamine derivatives of quinone and uses thereof CLINICAL DATA, INC. 2005-02-10 — — 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 (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-20140213627-A1 NAPHTHOQUINONE DERIVATIVES USEFUL FOR PREVENTION OF AMYLOID DEPOSITS AND TREATMENT OF DISEASES INVOLVING AMYLOIDOGENESIS APP, PSEN1, PSEN2 MAPT 14/4885HTT 13/4885RAB9A 2597/4885
US-20110224184-A1 NAPHTHOQUINONE DERIVATIVES USEFUL FOR PREVENTION OF AMYLOID DEPOSITS AND TREATMENT OF DISEASES INVOLVING AMYLOIDOGENESIS APP, PSEN1, PSEN2 MAPT 14/4885HTT 13/4885RAB9A 2597/4885
US-20050032794-A1 Diamine derivatives of quinone and uses thereof NQO1, DPYD, NQO2 MAPT 3849/4885HTT 3519/4885RAB9A 1436/4885

“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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