SCHEMBL790339

SCHEMBL790339

Brc1cccc(NNc2cccc(Br)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
ALDH1A1 P00352 3/20 0.52
KDM4E B2RXH2 1/20 0.52
IDO1 P14902 2/20 0.50
RAPGEF4 Q8WZA2 1/20 0.50
LMNA P02545 2/20 0.48
GAA P10253 1/20 0.48
CA1 P00915 1/20 0.48
MMP2 P08253 1/20 0.48
CA14 Q9ULX7 1/20 0.48
TGM2 P21980 1/20 0.48
HPGD P15428 1/20 0.48
ALOX12 P18054 1/20 0.48
MAPK1 P28482 1/20 0.46
P2RX1 P51575 1/20 0.44
NPC1 O15118 1/20 0.43
ALOX15 P16050 1/20 0.43
RAB9A P51151 1/20 0.43
CTSD P07339 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
SCHEMBL31068396 0.93 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4EIDO1
SCHEMBL28922554 0.93 ALDH1A1 (0.57) MEN1KMT2AALDH1A1KDM4EIDO1
SCHEMBL21436355 0.91 MEN1 (0.46) MEN1KMT2AALDH1A1KDM4EIDO1
SCHEMBL28200116 0.87 MEN1 (0.47) MEN1KMT2AALDH1A1KDM4EIDO1
SCHEMBL11073430 0.87 MAPT (0.50) MEN1KMT2AALDH1A1KDM4EIDO1
Hydrochloric Acid SCHEMBL8660554 0.85 MEN1 (0.46) MEN1KMT2AALDH1A1KDM4EIDO1
Hydrochloric Acid SCHEMBL8662102 0.85 RAPGEF4 (0.48) MEN1KMT2AALDH1A1KDM4EIDO1
SCHEMBL14586551 0.85 MEN1 (0.46) MEN1KMT2AALDH1A1KDM4EIDO1
SCHEMBL11581574 0.85 MEN1 (0.48) MEN1KMT2AALDH1A1KDM4EIDO1
Hydrochloric Acid SCHEMBL3642582 0.84 MEN1 (0.44) MEN1KMT2AALDH1A1KDM4EIDO1

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-9455410-B2 Micromolecular electron transport material based on pyridine and triazole, preparation method and organic light-emitting diode thereof SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD (CN) 2016-09-27 US disclosed
US-20150318485-A1 MICROMOLECULAR ELECTRON TRANSPORT MATERIAL BASED ON PYRIDINE AND TRIAZOLE, PREPARATION METHOD AND ORGANIC LIGHT-EMITTING DIODE THEREOF SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD (CN) 2015-11-05 US disclosed
EP-2616071-A2 FATTY ACID SYNTHASE INHIBITORS GlaxoSmithKline Intellectual Property Development Limited (GB) 2013-07-24 EP disclosed
US-20130172384-A1 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED 2013-07-04 US disclosed
WO-2012037299-A2 FATTY ACID SYNTHASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-03-22 WO disclosed
EP-0801649-A2 HYDROXYLAMINE DERIVATIVES USEFUL FOR ENHANCING THE MOLECULAR CHAPERON PRODUCTION AND THE PREPARATION THEREOF BIOREX KUTATO ES FEJLESZTÖ RT. (HU) 1997-10-22 EP disclosed
US-5652239-A TREATMENT OF STROKES, ISCHEMIC ATTACK, ANTAGONISTS OF EXCITATORY AMINO ACIDS GLUTAMATE AND ASPARTATE IMPERIAL CHEMICAL COMPANY (GB) 1997-07-29 US disclosed
WO-1997016439-A1 HYDROXYLAMINE DERIVATIVES USEFUL FOR ENHANCING THE MOLECULAR CHAPERON PRODUCTION AND THE PREPARATION THEREOF Biorex Kutató és Fejlesztó Rt. (HU) 1997-05-09 WO disclosed
EP-0512817-B1 Pyridazinedione derivatives, their preparation and pharmaceutical applications ZENECA LTD (GB) 1997-02-19 EP disclosed
EP-0512817-A1 Pyridazinedione derivatives, their preparation and pharmaceutical applications ZENECA LIMITED (GB) 1992-11-11 EP 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-20150318485-A1 MICROMOLECULAR ELECTRON TRANSPORT MATERIAL BASED ON PYRIDINE AND TRIAZOLE, PREPARATION METHOD AND ORGANIC LIGHT-EMITTING DIODE THEREOF TOMM34, MLNR, MAP1LC3B MEN1 1282/4885KMT2A 4270/4885ALDH1A1 1200/4885
US-20130172384-A1 FATTY ACID SYNTHASE INHIBITORS FASN, FADS1, FADS2 MEN1 4467/4885KMT2A 2500/4885ALDH1A1 671/4885

“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.