SCHEMBL428216

SCHEMBL428216

Cc1ccc(N[C]=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 1/20 0.48
TDP1 Q9NUW8 3/20 0.46
MAPT P10636 3/20 0.46
CA1 P00915 2/20 0.44
ACHE P22303 1/20 0.44
CA2 P00918 1/20 0.44
POLB P06746 1/20 0.44
HPGD P15428 4/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
ALOX12 P18054 1/20 0.40

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
SCHEMBL2321986 0.93 KIF11 (0.50) MEN1KMT2ALMNATDP1MAPT
SCHEMBL7789704 0.88 MEN1 (0.32) MEN1KMT2ALMNATDP1
SCHEMBL5537273 0.81 TSHR (0.43) MEN1KMT2ALMNAMAPTCA1
SCHEMBL21836010 0.80 ALDH1A1 (0.68) MEN1KMT2ALMNATDP1MAPT
SCHEMBL222552 0.77 ALDH1A1 (0.52) MEN1KMT2ALMNATDP1MAPT
SCHEMBL1318227 0.76 ALDH1A1 (0.44) MEN1KMT2ALMNAMAPTCA1
SCHEMBL10804520 0.76 ALDH1A1 (0.46) MEN1KMT2ALMNATDP1MAPT
SCHEMBL1486303 0.76 NPC1 (0.43) MEN1KMT2ALMNATDP1MAPT
SCHEMBL1712020 0.76 MAPT (0.46) MEN1KMT2ALMNATDP1MAPT
SCHEMBL515528 0.76 MEN1 (0.43) MEN1KMT2ALMNAMAPTCA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190330192-A1 SUBSTITUTED AZOLYLPYRROLONES AND AZOLYLHYDANTOINS AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2019-10-31 US claimed
EP-3558976-A1 SUBSTITUTED AZOLYLPYRROLONES AND AZOLYLHYDANTOINES AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES Bayer CropScience Aktiengesellschaft (DE) 2019-10-30 EP claimed
CN-104262267-B9 PGI2 receptor modulators for the treatment of prostacyclin (PGI2) receptor-related disorders 艾尼纳制药公司 2019-04-12 CN claimed
CN-104262267-B For treating the PGI2 receptor modulators of prostacyclin (PGI2) receptor associate disorder 艾尼纳制药公司 2019-02-26 CN claimed
WO-2015187082-A1 NEW PLASMA LIPID LOWERING AGENTS LIPIGON PHARMACEUTICALS AB (SE) 2015-12-10 WO claimed
US-RE44048-E1 4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-YL]benzenesulfonamide for the treatment of inflammation or an inflammation-associated disorder G.D. SEARLE LLC (US) 2013-03-05 US claimed
CN-102036659-A PGI2 receptor modulators for the treatment of prostacyclin receptor-related disorders ARENA PHARM INC 2011-04-27 CN claimed
EP-1135239-B1 WOOD PRESERVATIVE FORMULATIONS HICKSON INTERNAT PLC (GB) 2008-02-06 EP claimed
US-7217723-B2 Substituted benzothiophenes, e.g., 7Z)-7-hydroxyimino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-sulfonic acid [2-(4-fluorophenyl)-2-hydroxyethyl]-methyl-amide; treating allergies such as atopic dermatitis, allergic coryza, bronchial asthma, hypersensitive pneumoniac and pulmonary aspergillosis. EISAI CO., LTD. (JP) 2007-05-15 US claimed
US-20060160791-A1 Wood preservative formulations WILLIAMS GARETH 2006-07-20 US claimed
US-4675044-A DEFOLIANTS UNIROYAL CHEMICAL COMPANY, INC. (US) 1987-06-23 US claimed
US-4569690-A HERBICIDES, FUNGICIDES, PLANT DESSICANTS, DEFOLIANTS UNIROYAL, INC. (US) 1986-02-11 US claimed
US-4509948-A Cationic mono- and dis-azo dyestuffs, and their preparation and use for dyeing paper and cationic dyeable substrates BAYER AKTIENGESELLSCHAFT (DE) 1985-04-09 US claimed
EP-0104940-A1 3-Aryl-5,6-dihydro-1,4,2-oxathiazines and their oxides UNIROYAL, INC. (US) 1984-04-04 EP claimed
EP-0012112-B1 PRESSURE-SENSITIVE OR HEAT-SENSITIVE RECORDING MATERIAL CIBA-GEIGY AG (CH) 1983-10-05 EP claimed
US-4291901-A Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY CORPORATION (US) 1981-09-29 US claimed
EP-0012112-A1 Pressure-sensitive or heat-sensitive recording material CIBA-GEIGY AG (CH) 1980-06-11 EP claimed
US-4006163-A POLYESTERS CIBA-GEIGY CORPORATION (US) 1977-02-01 US claimed
US-4002635-A FOR COLORING PLASTICS AND LACQUERS CIBA-GEIGY CORPORATION (US) 1977-01-11 US claimed
US-3954830-A Yellow methine dyes for hydrophobic textile material AMERICAN ANILINE PRODUCTS, INC. (US) 1976-05-04 US claimed

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-20060160791-A1 Wood preservative formulations ATL3, WIZ, NNT MEN1 2283/4885KMT2A 1557/4885LMNA 143/4885
US-20190330192-A1 SUBSTITUTED AZOLYLPYRROLONES AND AZOLYLHYDANTOINS AND SALTS THEREOF AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES AGPS, AASDHPPT, HPD MEN1 2887/4885KMT2A 872/4885LMNA 4727/4885

“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.