SCHEMBL14726313

SCHEMBL14726313

COc1ccc2nc(-c3cccnc3)nc(N3CCc4cc(Cl)ccc43)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ TUBB4A P04350 5/20 0.48
▸ TUBB P07437 5/20 0.48
▸ TUBA3C P0DPH7 5/20 0.48
▸ TUBA1B P68363 5/20 0.48
▸ TUBA4A P68366 5/20 0.48
▸ TUBB4B P68371 5/20 0.48
▸ TUBB3 Q13509 5/20 0.48
▸ TUBB2A Q13885 5/20 0.48
▸ TUBB8 Q3ZCM7 5/20 0.48
▸ TUBA3E Q6PEY2 5/20 0.48
▸ TUBA1A Q71U36 5/20 0.48
▸ TUBA1C Q9BQE3 5/20 0.48
▸ TUBB6 Q9BUF5 5/20 0.48
▸ TUBB2B Q9BVA1 5/20 0.48
▸ TUBB1 Q9H4B7 5/20 0.48
▸ EGFR P00533 3/20 0.48
▸ PDGFRB P09619 3/20 0.48

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
SCHEMBL16183302 0.93 MAPT (0.49) GAAMAPTALDH1A1TUBB4ATUBB
SCHEMBL16183298 0.93 ALDH1A1 (0.49) GAAMAPTALDH1A1TUBB4ATUBB
SCHEMBL14474807 0.91 GBA1 (0.49) GAAMAPTALDH1A1CYP11B2CYP11B1
SCHEMBL14474806 0.91 ALDH1A1 (0.43) GAAMAPTALDH1A1TUBB4ATUBB
SCHEMBL16183295 0.90 TUBB4A (0.49) GAAMAPTALDH1A1TUBB4ATUBB
SCHEMBL14358632 0.90 ABCG2 (0.55) GAAMAPTALDH1A1TUBB4ATUBB
Hydrochloric Acid SCHEMBL14358828 0.89 ABCG2 (0.54) GAAMAPTALDH1A1TUBB4ATUBB
SCHEMBL14474643 0.89 MAPT (0.49) GAAMAPTALDH1A1TUBB4ATUBB
SCHEMBL14358737 0.89 MAPT (0.49) GAAMAPTALDH1A1TUBB4ATUBB
SCHEMBL14726317 0.89 GAA (0.49) GAAMAPTALDH1A1TUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-08-03 — — US disclosed
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-08-03 — — US disclosed
US-9630947-B2 Therapeutic compounds and related methods of use OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-04-25 — — US disclosed
US-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE GALENEA CORPORATION 2015-10-29 — — US disclosed
US-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE GALENEA CORPORATION 2015-10-29 — — US disclosed
US-9073890-B2 Therapeutic compounds and related methods of use OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-07-07 — — US disclosed
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL COMPANY (JP) 2013-02-28 — — US disclosed
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL COMPANY (JP) 2013-02-28 — — 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 (4 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-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PTPRG, PPP2CA GAA 339/4885MAPT 519/4885ALDH1A1 2216/4885
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PPP3CB, PTPRG GAA 1062/4885MAPT 417/4885ALDH1A1 2732/4885
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PTPRG, PPP2CA GAA 339/4885MAPT 519/4885ALDH1A1 2216/4885
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP2CA, PPP4C, PPP3CB GAA 406/4885MAPT 509/4885ALDH1A1 1687/4885

“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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