SCHEMBL221718

SCHEMBL221718

Cc1cc(Br)cc(C(=O)O)c1N

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.66
GLA P06280 1/20 0.50
AKR1C3 P42330 2/20 0.47
AKR1C2 P52895 2/20 0.47
AKR1C1 Q04828 2/20 0.47
AKR1C4 P17516 1/20 0.47
HSD17B10 Q99714 1/20 0.46
GABRP O00591 1/20 0.43
GABRD O14764 1/20 0.43
GABRA1 P14867 1/20 0.43
GABRB1 P18505 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
GABRA2 P47869 1/20 0.43
GABRB2 P47870 1/20 0.43
GABRA4 P48169 1/20 0.43
GABRE P78334 1/20 0.43
GABRA6 Q16445 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
SCHEMBL19110932 0.84 KDM4E (0.46) KDM4EGLAAKR1C3AKR1C2AKR1C1
SCHEMBL29413053 0.84 KDM4E (0.46) KDM4EGLAAKR1C3AKR1C2AKR1C1
SCHEMBL2154955 0.84 KDM4E (0.46) KDM4EGLAAKR1C3AKR1C2AKR1C1
SCHEMBL28051617 0.80 KDM4E (0.60) KDM4EGLAHSD17B10GABRPGABRD
SCHEMBL19705808 0.80 KDM4E (0.41) KDM4EGLAAKR1C3AKR1C2AKR1C1
SCHEMBL759268 0.79 KDM4E (0.47) KDM4EGLAHSD17B10MAPTNOTUM
SCHEMBL634151 0.79 KDM4E (0.42) KDM4EGLAHSD17B10MAPTPOLB
SCHEMBL24399523 0.79 AKR1C3 (0.50) KDM4EGLAAKR1C3AKR1C2AKR1C1
SCHEMBL5424439 0.79 KDM4E (0.70) KDM4EHSD17B10GABRPGABRDGABRA1
SCHEMBL1553215 0.79 KDM4E (0.70) KDM4EAKR1C2AKR1C1HSD17B10GABRP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118406035-A Preparation method of cyantraniliprole metabolite IN-PLT97 山东亿盛实业股份有限公司 2024-07-30 CN claimed
CN-104031026-A O-formylamino benzamide derivatives containing N-cyano sulfone(sulfur)imine, preparation method thereof and uses thereof UNIV NANKAI 2014-09-10 CN claimed
EP-1903030-B1 Method for catalytic manufacture of aromatic or heteroaromatic nitriles SALTIGO GMBH (DE) 2014-06-04 EP claimed
CN-103172613-A O-formamido benzamide derivative containing N-cyano sulfone (sulfur) imine and preparation method and application thereof UNIV NANKAI 2013-06-26 CN claimed
US-7592452-B2 Process for catalytically preparing aromatic or heteroaromatic nitriles SALTIGOGMBH (DE) 2009-09-22 US claimed
US-20090062541-A1 Process for catalytically preparing aromatic or heteroaromatic nitriles SALTIGO GMBH (DE) 2009-03-05 US claimed
EP-1903030-A1 Method for catalytic manufacture of aromatic or heteroaromatic nitriles Saltigo GmbH (DE) 2008-03-26 EP claimed
EP-4680612-A1 CHEMICAL COMPOUNDS AN2 Therapeutics, Inc. (US) 2026-01-21 EP disclosed
EP-3589628-B1 ARYL, HETEROARYL, AND HETEROCYCLIC PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS INC (US) 2025-05-07 EP disclosed
WO-2025067468-A1 CBL-B INHIBITORS AND METHODS OF USES THEREOF INSILICO MEDICINE IP LIMITED (CN) 2025-04-03 WO disclosed
US-12162860-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders ACHILLION PHARMACEUTICALS, INC. (US) 2024-12-10 US disclosed
CN-112566906-B Substituted quinazolinone derivatives and their use as positive allosteric modulators of MGLUR4 多曼治疗学公司 2024-11-12 CN disclosed
US-20240327395-A1 A PROCESS FOR PREPARING BENZOXAZINONE COMPOUNDS TAGROS CHEMICALS INDIA PVT LTD (IN) 2024-10-03 US disclosed
EP-1175406-A1 IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2002-01-30 EP disclosed
EP-0938471-B1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID CO (US) 2001-12-12 EP disclosed
WO-2000066563-A1 IMIDAZOLINE DERIVATIVES AS ALPHA-1A ADRENOCEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2000-11-09 WO disclosed
CN-1240429-A Preparation and use of ortho-sulfonamido aryl hydroxamic acids as matrix metalloproteinase and TACE inhibitors AMERICAN CYANAMID CO (US) 2000-01-05 CN disclosed
EP-0938471-A1 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS American Cyanamid Company (US) 1999-09-01 EP disclosed
US-5929097-A INHIBIT TUMOR NECROSIS FACTOR-ALPHA CONVERTING ENZYME AMERICAN CYANAMID COMPANY (US) 1999-07-27 US disclosed
WO-1998016503-A2 THE PREPARATION AND USE OF ORTHO-SULFONAMIDO ARYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE AND TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-04-23 WO 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-20090062541-A1 Process for catalytically preparing aromatic or heteroaromatic nitriles AHR, PAH, AOC3 KDM4E 612/4885GLA 3384/4885AKR1C3 49/4885
US-20240327395-A1 A PROCESS FOR PREPARING BENZOXAZINONE COMPOUNDS XDH, PDHX, CYP11B1 KDM4E 1398/4885GLA 2449/4885AKR1C3 396/4885
US-12162860-B2 Aryl, heteroaryl, and heterocyclic pharmaceutical compounds for treatment of medical disorders CFD, TFPI, CFH KDM4E 3553/4885GLA 1819/4885AKR1C3 90/4885

“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.