SCHEMBL12246754

SCHEMBL12246754

[C-]#[N+]c1cc(Br)cc(C#N)c1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 2/20 0.39
▸ ALB P02768 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PGR P06401 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31

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
SCHEMBL12587111 0.84 TTR (0.36) TTRALBMEN1KMT2A
SCHEMBL504640 0.77 TTR (0.52) TTRALBMEN1KMT2APGR
SCHEMBL200313 0.77 TTR (0.52) TTRALBMEN1KMT2APGR
SCHEMBL12798241 0.75 GRM5 (0.35) PGR
SCHEMBL10251503 0.75 TTR (0.39) TTRALBMEN1KMT2A
SCHEMBL12399933 0.75 ALDH1A1 (0.38) TTRALBMEN1KMT2APGR
SCHEMBL12399938 0.75 MEN1 (0.31) TTRALBMEN1KMT2A
SCHEMBL12551765 0.72 LOXL2 (0.31) —
SCHEMBL12399930 0.71 GRM5 (0.35) TTRALBMEN1KMT2A
SCHEMBL12399929 0.71 — —

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
US-20230301181-A1 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME LAPTO CO., LTD. (KR) 2023-09-21 — — US disclosed
US-20230149414-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. 2023-05-18 — — US disclosed
US-20170263871-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2017-09-14 — — US disclosed
US-9045510-B2 Iridium complex, organic light-emitting device, and image display apparatus CANON KABUSHIKI KAISHA (JP) 2015-06-02 — — US disclosed
US-8921359-B2 Inhibitors of beta-secretase VITAE PHARMACEUTICALS, INC. (US) 2014-12-30 — — US disclosed
US-8450308-B2 Inhibitors of beta-secretase VITAE PHARMACEUTICALS, INC. (US) 2013-05-28 — — US disclosed
US-20120273769-A1 NOVEL IRIDIUM COMPLEX, ORGANIC LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2012-11-01 — — US disclosed
US-20110218192-A1 Inhibitors Of Beta-Secretase VITAE PHARMACEUTICALS, INC. (US) 2011-09-08 — — US disclosed
US-20070111024-A1 Metal complex compound and organic electroluminescence device containing the same IDEMITSU KOSAN CO., LTD. (JP) 2007-05-17 — — 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 (5 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-20230149414-A1 COMPOUNDS AND USES THEREOF VHL, CLN6, TFEB TTR 3059/4885ALB 4644/4885MEN1 1366/4885
US-20110218192-A1 Inhibitors Of Beta-Secretase BACE1, BACE2, APP TTR 1344/4885ALB 4757/4885MEN1 813/4885
US-20230301181-A1 TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME SAT1, FTO, SETDB1 TTR 3424/4885ALB 1381/4885MEN1 2032/4885
US-20170263871-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND ORGANIC OPTOELECTRONIC DEVICE OR10J3, RPS10, OR51E2 TTR 2471/4885ALB 907/4885MEN1 833/4885
US-20120273769-A1 NOVEL IRIDIUM COMPLEX, ORGANIC LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS ZKSCAN2, OCIAD1, OCIAD2 TTR 4477/4885ALB 3165/4885MEN1 1636/4885

“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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