SCHEMBL976269

SCHEMBL976269

O=C1Oc2ccccc2Nc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 7/20 0.64
▸ PDGFRA P16234 1/20 0.52
▸ FER P16591 1/20 0.52
▸ LTK P29376 1/20 0.52
▸ CDK8 P49336 1/20 0.52
▸ ACVR1 Q04771 1/20 0.52
▸ LRRK2 Q5S007 1/20 0.52
▸ DYRK1B Q9Y463 1/20 0.52
▸ MAOA P21397 1/20 0.47
▸ MAOB P27338 1/20 0.47
▸ TDP1 Q9NUW8 2/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ TYMS P04818 1/20 0.44
▸ MAPT P10636 2/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ PARP1 P09874 1/20 0.43
▸ POLB P06746 1/20 0.43

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
SCHEMBL9094667 0.81 ALOX5 (0.50) ALOX5PDGFRATDP1MEN1KMT2A
Phenoxazine SCHEMBL29355714 0.79 ALOX5 (1.00) ALOX5TDP1MEN1KMT2AMAPT
Phenoxazine SCHEMBL6310178 0.79 ALOX5 (1.00) ALOX5TDP1MEN1KMT2AMAPT
Phenoxazine SCHEMBL28844098 0.79 ALOX5 (1.00) ALOX5TDP1MEN1KMT2AMAPT
Phenoxazine SCHEMBL7862 0.79 ALOX5 (1.00) ALOX5TDP1MEN1KMT2AMAPT
SCHEMBL31599584 0.78 ALOX5 (0.70) ALOX5PDGFRAFERLTKCDK8
SCHEMBL380110 0.78 ALOX5 (0.61) ALOX5PDGFRAFERLTKCDK8
SCHEMBL5739379 0.77 MAPT (0.52) ALOX5TDP1MEN1KMT2AMAPT
SCHEMBL5937361 0.77 CYP1A2 (0.61) ALOX5ALOX15MEN1KMT2ATYMS
Phenoxazine SCHEMBL25275195 0.77 ALOX5 (0.94) ALOX5TDP1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019161781-A1 RECEPTOR ANTAGONIST, PHARMACEUTICAL COMPOSITION COMPRISING SAME, AND USAGE THEREOF 北京泰德制药股份有限公司 2019-08-29 — — WO disclosed
US-20140221468-A1 Compounds that Modulate Store Operated Calcium Channels THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2014-08-07 — — US disclosed
US-8673911-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2014-03-18 — — US disclosed
WO-2012079020-A2 COMPOUNDS THAT MODULATE STORE OPERATED CALCIUM CHANNELS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2012-06-14 — — WO disclosed
US-8158623-B2 Heptacyclic compounds and the pharmaceutical uses thereof for preventing and treating diabetes and metabolic syndrome SHANGHAI INSTITUTE OF MATERIA MEDICA CHINESE ACADEMY OF SCIENCES (CN) 2012-04-17 — — US disclosed
US-20110021771-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2011-01-27 — — US disclosed
US-20100173905-A1 HEPTACYCLIC COMPOUNDS AND THE PHARMACEUTICAL USES THEREOF FOR PREVENTING AND TREATING DIABETES AND METABOLIC SYNDROME SHANGHAI INSTITUTE OF MATERIA MEDICA CHINESE ACADEMY OF SCIENCE 2010-07-08 — — US disclosed
EP-2199295-A1 COMPOUNDS WITH 7-MEMBER CYCLE AND THE PHARMACEUTICAL USE THEREOF FOR PREVENTING AND TREATING DIABETES AND METABOLISM SYNDROME Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2010-06-23 — — EP disclosed
US-5104980-A CHROMOGENIC DIBENZOXAZEPINONE AND DIBENZOTHIAZEPINONE ENZYME SUBSTRATES MILES INC. (US) 1992-04-14 — — 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-20110021771-A1 INHIBITORS OF HISTONE DEACETYLASE HDAC1, HDAC11, HDAC3 ALOX5 2621/4885PDGFRA 4656/4885FER 4157/4885
US-20140221468-A1 Compounds that Modulate Store Operated Calcium Channels CACNA1C, SARAF, CACNA1G ALOX5 473/4885PDGFRA 2277/4885FER 4445/4885
US-20100173905-A1 HEPTACYCLIC COMPOUNDS AND THE PHARMACEUTICAL USES THEREOF FOR PREVENTING AND TREATING DIABETES AND METABOLIC SYNDROME GPR119, CYP11B1, HSD11B1 ALOX5 73/4885PDGFRA 3886/4885FER 2821/4885

“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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