SCHEMBL3496264

SCHEMBL3496264

Brc1ccc(-n2cnc3ccccc32)cc1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.72
FGFR1 P11362 5/20 0.69
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MAPT P10636 1/20 0.52
KMT2A Q03164 1/20 0.52
PTK2B Q14289 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52

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
Bromobenzene SCHEMBL28699914 0.91 HTT (0.82) HTTFGFR1
SCHEMBL3419279 0.90 HTT (0.88) HTTFGFR1KDM4EALDH1A1RAB9A
SCHEMBL30402227 0.90 HTT (0.88) HTTFGFR1KDM4EALDH1A1RAB9A
SCHEMBL2531256 0.85 HTT (0.78) HTTFGFR1KDM4EALDH1A1RAB9A
Benzene SCHEMBL14876970 0.84 HTT (1.00) HTTFGFR1
SCHEMBL157265 0.84 HTT (1.00) HTTFGFR1
SCHEMBL23243817 0.84 HTT (0.65) HTTFGFR1
SCHEMBL30892592 0.84 HTT (0.65) HTTFGFR1
SCHEMBL5246440 0.83 HTT (0.75) HTTFGFR1KDM4EALDH1A1RAB9A
Iodide SCHEMBL30645138 0.82 HTT (0.96) HTTFGFR1

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114989094-B Method for synthesizing benzimidazole derivative by visible light catalysis 云南民族大学 2023-09-29 CN disclosed
CN-114989094-A Method for synthesizing benzimidazole derivative by visible light catalysis 云南民族大学 2022-09-02 CN disclosed
US-10651399-B2 Delayed fluorescence compound, and organic light emitting diode and display device using the same LG DISPLAY CO., LTD. (KR) 2020-05-12 US disclosed
US-10617685-B2 Nonsteroidal and steroidal compounds with potent androgen receptor down-regulation and anti prostate cancer activity UNIVERSITY OF MARYLAND, BALTIMORE (US) 2020-04-14 US disclosed
US-10617685-B2 Nonsteroidal and steroidal compounds with potent androgen receptor down-regulation and anti prostate cancer activity UNIVERSITY OF MARYLAND, BALTIMORE (US) 2020-04-14 US disclosed
EP-3514147-A1 STEROIDAL COMPOUNDS WITH POTENT ANDROGEN RECEPTOR DOWN-REGULATION AND ANTI PROSTATE CANCER ACTIVITY University of Maryland, Baltimore (US) 2019-07-24 EP disclosed
US-20190036035-A1 Delayed Fluorescence Compound, and Organic Light Emitting Diode and Display Device Using the Same LG DISPLAY CO., LTD. (KR) 2019-01-31 US disclosed
US-10193085-B2 Delayed fluorescence compound, and organic light emitting diode and display device using the same LG DISPLAY CO., LTD. (KR) 2019-01-29 US disclosed
US-20180205023-A1 Delayed Fluorescence Compound, and Organic Light Emitting Diode and Display Device Using the Same LG DISPLAY CO., LTD. (KR) 2018-07-19 US disclosed
US-20180205023-A1 Delayed Fluorescence Compound, and Organic Light Emitting Diode and Display Device Using the Same LG DISPLAY CO., LTD. (KR) 2018-07-19 US disclosed
EP-2565185-A1 [5,6]HETEROCYCLIC COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-03-06 EP disclosed
US-20130029964-A1 [5, 6] HETEROCYCLIC COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-01-31 US disclosed
US-7803825-B2 Aminoalkylazole derivatives as histamine-3 antagonists WYETH LLC (US) 2010-09-28 US disclosed
US-7803825-B2 Aminoalkylazole derivatives as histamine-3 antagonists WYETH LLC (US) 2010-09-28 US disclosed
US-7803825-B2 Aminoalkylazole derivatives as histamine-3 antagonists WYETH LLC (US) 2010-09-28 US disclosed
EP-2170875-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS Wyeth LLC (US) 2010-04-07 EP disclosed
US-20090023707-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2009-01-22 US disclosed
US-20090023707-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2009-01-22 US disclosed
WO-2009012252-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2009-01-22 WO disclosed
US-20090023707-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS WYETH (US) 2009-01-22 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 (6 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-20090023707-A1 AMINOALKYLAZOLE DERIVATIVES AS HISTAMINE-3 ANTAGONISTS HRH4, HRH3, HRH2 HTT 775/4885FGFR1 2784/4885KDM4E 2778/4885
US-10193085-B2 Delayed fluorescence compound, and organic light emitting diode and display device using the same OCIAD1, OCIAD2, OGFOD1 HTT 1868/4885FGFR1 689/4885KDM4E 3098/4885
US-20130029964-A1 [5, 6] HETEROCYCLIC COMPOUND BMP2, BMP4, SOST HTT 4682/4885FGFR1 128/4885KDM4E 1999/4885
US-10651399-B2 Delayed fluorescence compound, and organic light emitting diode and display device using the same OCIAD1, OCIAD2, DRD2 HTT 705/4885FGFR1 1988/4885KDM4E 2711/4885
US-10617685-B2 Nonsteroidal and steroidal compounds with potent androgen receptor down-regulation and anti prostate cancer activity AR, NR5A1, BRCA1 HTT 1667/4885FGFR1 1290/4885KDM4E 1575/4885
US-20190036035-A1 Delayed Fluorescence Compound, and Organic Light Emitting Diode and Display Device Using the Same OCIAD1, OCIAD2, DRD2 HTT 705/4885FGFR1 1988/4885KDM4E 2711/4885

“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.