SCHEMBL2403679

SCHEMBL2403679

Cc1cc([N+](=O)[O-])c(Cl)cc1C#N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 5/20 0.51
MERTK Q12866 2/20 0.44
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
MAPT P10636 4/20 0.41
GRIA1 P42261 2/20 0.41
GRIA2 P42262 2/20 0.41
GRIA3 P42263 2/20 0.41
GRIA4 P48058 2/20 0.41
CYP1A2 P05177 2/20 0.41
GRM6 O15303 1/20 0.41
ALOX15 P16050 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP3A4 P08684 1/20 0.41
PGK1 P00558 1/20 0.41
HPGD P15428 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.41
CYP2C9 P11712 1/20 0.41
APEX1 P27695 1/20 0.41

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
SCHEMBL1625612 0.93 VCAM1 (0.51) VCAM1MERTKTSHRMAPK1MAPT
SCHEMBL1344102 0.86 VCAM1 (0.56) VCAM1MERTKTSHRMAPK1MAPT
SCHEMBL7642508 0.85 VCAM1 (0.58) VCAM1MERTKTSHRMAPK1MAPT
SCHEMBL773066 0.85 VCAM1 (0.49) VCAM1TSHRMAPTGRIA1GRIA2
SCHEMBL9536669 0.84 VCAM1 (0.56) VCAM1MERTKTSHRMAPK1MAPT
SCHEMBL1343713 0.84 VCAM1 (0.61) VCAM1MERTKTSHRMAPK1MAPT
SCHEMBL7024321 0.84 VCAM1 (0.47) VCAM1TSHRMAPTGRIA1GRIA2
SCHEMBL14739198 0.80 VCAM1 (0.47) VCAM1TSHRMAPTGRIA1GRIA2
SCHEMBL1624405 0.80 VCAM1 (0.56) VCAM1MERTKTSHRMAPK1MAPT
SCHEMBL1344104 0.79 VCAM1 (0.51) VCAM1MERTKTSHRMAPTGRIA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260146044-A1 AROMATIC COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF INCRELAND (CN) 2026-05-28 US disclosed
EP-4745142-A1 AROMATIC COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF Increland (CN) 2026-05-20 EP disclosed
US-20260042749-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2026-02-12 US disclosed
US-12545659-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2026-02-10 US disclosed
US-20250121073-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-04-17 US disclosed
WO-2025061203-A1 IRAK DEGRADATION AGENT AND USE THEREOF 成都茵创园医药科技有限公司 2025-03-27 WO disclosed
WO-2025011655-A1 AROMATIC COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF 成都茵创园医药科技有限公司 2025-01-16 WO disclosed
US-12150995-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2024-11-26 US disclosed
US-20240059674-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2024-02-22 US disclosed
EP-4271664-A1 IRAK DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2023-11-08 EP disclosed
EP-2217596-B1 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 MERCK SHARP & DOHME (US) 2013-01-30 EP disclosed
US-20110212938-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 SCHERING CORPORATION 2011-09-01 US disclosed
EP-2217596-A2 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 Schering Corporation (US) 2010-08-18 EP disclosed
WO-2009055331-A2 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 SCHERING CORPORATION (US) 2009-04-30 WO disclosed
US-5968958-A NON-STEROIDAL ANTIINFLAMMATORY AGENTS OR ENZYME INHIBITORS MERCK FROSST CANADA, INC. (CA) 1999-10-19 US disclosed
WO-1996023786-A1 5-METHANESULFONAMIDO-3H-ISOBENZOFURAN-1-ONES AS INHIBITORS OF CYCLOOXYGENASE-2 MERCK FROSST CANADA INC. (CA) 1996-08-08 WO disclosed
EP-0273369-B1 NEW ALKANESULFONANILIDE DERIVATIVES, PROCESSES FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-03-04 EP disclosed
US-4866091-A ANTINFLAMMATORY AGENTS, ANALGESICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1989-09-12 US disclosed
CN-87108295-A New alkane sulfonyl aniline derivative and its medicinal compositions and preparation method 1988-07-13 CN disclosed
EP-0273369-A2 New alkanesulfonanilide derivatives, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-07-06 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 (7 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-12545659-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK4 VCAM1 3876/4885MERTK 1044/4885TSHR 629/4885
US-20260146044-A1 AROMATIC COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND USE THEREOF IRAK4, IRAK2, IRAK1 VCAM1 1737/4885MERTK 1386/4885TSHR 3793/4885
US-20250121073-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 VCAM1 3606/4885MERTK 497/4885TSHR 3319/4885
US-12150995-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 VCAM1 3606/4885MERTK 497/4885TSHR 3319/4885
US-20260042749-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK4 VCAM1 4298/4885MERTK 2201/4885TSHR 334/4885
US-20240059674-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 VCAM1 3606/4885MERTK 497/4885TSHR 3319/4885
US-20110212938-A1 BICYCLIC HETEROCYCLE DERIVATIVES AND THEIR USE AS MODULATORS OF THE ACTIVITY OF GPR119 GPR119, GPR88, GPR180 VCAM1 1347/4885MERTK 1567/4885TSHR 916/4885

“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.