SCHEMBL4958280

SCHEMBL4958280

CCCc1cccc(C(C)=O)c1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.51
MAOB P27338 5/20 0.50
CYP4F2 P78329 3/20 0.49
CYP4A11 Q02928 3/20 0.49
HPGD P15428 2/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
CTSS P25774 1/20 0.47
CTSK P43235 1/20 0.47
LMNA P02545 1/20 0.45
MAOA P21397 1/20 0.45
IL4I1 Q96RQ9 1/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL8341269 0.89 CYP4F2 (0.53) MAOBCYP4F2CYP4A11HPGDRAB9A
SCHEMBL755940 0.87 LPL (0.54) CYP4F2CYP4A11HPGDRAB9ALMNA
SCHEMBL11752450 0.86 KAT6A (0.52) KAT6ACYP4F2CYP4A11
SCHEMBL27841873 0.86 LPL (0.55) CYP4F2CYP4A11
SCHEMBL11434969 0.86 LPL (0.55) CYP4F2CYP4A11
SCHEMBL30354557 0.85 FOLH1 (0.61) KAT6ARAB9A
SCHEMBL9660695 0.85 MAOB (0.58) MAOBCYP4F2CYP4A11RAB9ANPC1
SCHEMBL8093173 0.85 KAT6A (0.51) KAT6ACYP4F2CYP4A11ALDH1A1
SCHEMBL991080 0.85 FOLH1 (0.61) KAT6ARAB9A
SCHEMBL12235066 0.85 CYP4F2 (0.67) MAOBCYP4F2CYP4A11MAPK1LMNA

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240376091-A1 THIADIAZOLEAMIDE DERIVATIVES AND THEIR APPLICATIONS ZHEJIANG UNIVERSITY (CN) 2024-11-14 US disclosed
WO-2023238127-A1 UBIQUITIN HIGH AFFINITY CYCLIC PEPTIDES AND METHODS OF USE THEREOF TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) 2023-12-14 WO disclosed
EP-2509602-B1 PYRAZOLOPYRIMIDINES AND RELATED HETEROCYCLES AS CK2 INHIBITORS SENHWA BIOSCIENCES INC (TW) 2017-01-25 EP disclosed
US-20160045528-A1 COMBINATION THERAPY FOR TREATING A PARAMYXOVIRUS ALIOS BIOPHARMA, INC. 2016-02-18 US disclosed
US-8680270-B2 Metallo-oxidoreductase inhibitors using metal binding moieties in combination with targeting moieties VIAMET PHARMACEUTICALS, INC. (US) 2014-03-25 US disclosed
US-8507727-B2 Method for producing cyclohexyl alkyl ketones MITSUBISHI GAS CHEMCIAL COMPANY, INC. (JP) 2013-08-13 US disclosed
US-8309587-B2 Piperidine and piperazine phenyl sulphonamides as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-11-13 US disclosed
EP-2479163-A1 METHOD FOR PRODUCING CYCLOHEXYL ALKYL KETONES Mitsubishi Gas Chemical Company, Inc. (JP) 2012-07-25 EP disclosed
US-20120178713-A1 PHENYL SULPHONAMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-12 US disclosed
US-20120178970-A1 METHOD FOR PRODUCING CYCLOHEXYL ALKYL KETONES MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2012-07-12 US disclosed
US-20100305078-A1 METALLO-OXIDOREDUCTASE INHIBITORS USING METAL BINDING MOIETIES IN COMBINATION WITH TARGETING MOIETIES VIAMET PHARMACEUTICALS, INC. (US) 2010-12-02 US disclosed
US-20080125432-A1 5-Carboxamido Substituted Thiazole Derivatives that Interact With Ion Channels, In Particular With Ion Channels From the Kv Family DEVGEN NV (BE) 2008-05-29 US disclosed
EP-1131290-B1 PIPERIDINE CCR-3 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2008-02-20 EP disclosed
US-6770650-B2 CHEMOKINE RECEPTOR (CCR) ANTAGONISTS SUCH AS N-(1(S)-(4-(3,4-DICHLOROBENZYL)PIPERAZIN-1-YLMETHYL)-2-METHYLPROPYL)-4 -METHYLBENZAMIDE DIHYDROCHLORIDE SALT FOR TREATMENT OF ASTHMA SYNTEX (U.S.A.) LLC 2004-08-03 US disclosed
US-6342509-B1 ANTIASTHMATICS, ANTIHISTAMINES OR BRONCHODIALATORS SYNTEX (U.S.A.) LLC 2002-01-29 US disclosed
US-6339087-B1 FOR THERAPY OF INFLAMMATORY OR ALLERGIC DISEASES ARE SELECTED FROM ASTHMA, ALLERGIC RHINITIS, HYPERSENSITIVITY LUNG DISEASES, HYPERSENSITIVITY PNEUMONITIS, EOSINOPHILIC PNEUMONIAS, INFLAMMATORY BOWEL DISEASES, PSORIASIS, DERMATITIS SYNTEX (U.S.A.) LLC 2002-01-15 US disclosed
EP-0037187-B1 SALTS AND AQUEOUS SOLUTIONS OF 6-METHYLAMINO-4-OXO-10-PROPYL-4H-PYRANO(3,2-G)-QUINOLINE-2,8-DI-CARBOXYLIC ACID AND PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH SALTS AND SOLUTIONS FISONS plc (GB) 1986-12-10 EP disclosed
EP-0108592-A1 Leukotriene antagonists ELI LILLY AND COMPANY (US) 1984-05-16 EP disclosed
US-4438277-A Hydronaphthalene derivatives SANKYO COMPANY, LIMITED (JP) 1984-03-20 US disclosed
US-4361515-A Antihyperlipemic dihydro-ML-236B derivatives, their preparation and use SANKYO COMPANY, LIMITED (JP) 1982-11-30 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-20120178713-A1 PHENYL SULPHONAMIDES AS MODULATORS OF ION CHANNELS TRPV1, TRPA1, TRPV5 KAT6A 1932/4885MAOB 2728/4885CYP4F2 3666/4885
US-20240376091-A1 THIADIAZOLEAMIDE DERIVATIVES AND THEIR APPLICATIONS AR, GPER1, CYP19A1 KAT6A 1252/4885MAOB 2054/4885CYP4F2 1004/4885
US-20160045528-A1 COMBINATION THERAPY FOR TREATING A PARAMYXOVIRUS MAVS, EIF2AK2, SARS1 KAT6A 3278/4885MAOB 3969/4885CYP4F2 4240/4885
US-20100305078-A1 METALLO-OXIDOREDUCTASE INHIBITORS USING METAL BINDING MOIETIES IN COMBINATION WITH TARGETING MOIETIES NQO1, SOD1, MDH2 KAT6A 1685/4885MAOB 112/4885CYP4F2 351/4885
US-20120178970-A1 METHOD FOR PRODUCING CYCLOHEXYL ALKYL KETONES HACL2, ALKBH3, HSD17B7 KAT6A 426/4885MAOB 2770/4885CYP4F2 101/4885
US-20080125432-A1 5-Carboxamido Substituted Thiazole Derivatives that Interact With Ion Channels, In Particular With Ion Channels From the Kv Family KCNA5, KCNA1, KCNJ2 KAT6A 2266/4885MAOB 3466/4885CYP4F2 1046/4885

“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.