SCHEMBL461448

SCHEMBL461448

COC(c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.47
TDO2 P48775 4/20 0.47
SCN1A P35498 3/20 0.45
SCN2A Q99250 3/20 0.45
SCN3A Q9NY46 3/20 0.45
LMNA P02545 2/20 0.45
TSHR P16473 2/20 0.45
CYP1A2 P05177 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45
CHRM5 P08912 1/20 0.45
ADRA2A P08913 1/20 0.45
CYP2D6 P10635 1/20 0.45
CHRM1 P11229 1/20 0.45
ADRA2B P18089 1/20 0.45
CHRM3 P20309 1/20 0.45
SLC6A2 P23975 1/20 0.45
HRH2 P25021 1/20 0.45
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45

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
SCHEMBL23296602 0.97 IDO1 (0.46) IDO1TDO2SCN1ASCN2ASCN3A
SCHEMBL13697238 0.88 MLKL (0.51) IDO1TDO2LMNATSHRSMN1; SMN2
SCHEMBL9097250 0.88 SMN1; SMN2 (0.50) IDO1TDO2CYP2D6SLC6A2SLC6A4
SCHEMBL6751142 0.88 IDO1 (0.41) IDO1TDO2SCN1ASCN2ASCN3A
SCHEMBL13772542 0.86 IDO1 (0.64) IDO1TDO2LMNATSHRCYP1A2
SCHEMBL17599983 0.86 ACP3 (0.56) TSHRNPSR1MAPK1CA4
SCHEMBL15960120 0.86 IDO1 (0.39) IDO1TDO2SCN1ASCN2ASCN3A
SCHEMBL23296776 0.86 IDO1 (0.39) IDO1TDO2SCN1ASCN2ASCN3A
SCHEMBL7586879 0.86 IDO1 (0.39) IDO1TDO2SCN1ASCN2ASCN3A
SCHEMBL1773224 0.86 SLC6A4 (0.54) IDO1TDO2LMNACHRM2ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210130408-A1 COMPOUND AND METHOD FOR PRODUCING THE SAME PUSAN NATIONAL UNIVERSITY INDUSTRY-UNIVERSITY COOPERATION FOUNDATION (KR) 2021-05-06 US claimed
EP-2621462-B1 ORAL CARE COMPOSITIONS WITH IMPROVED FLAVOR PROCTER & GAMBLE (US) 2020-02-12 EP claimed
CN-104844426-A Bis anisole derivative synthesis method UNIV CHONGQING 2015-08-19 CN claimed
EP-2621462-A1 ORAL CARE COMPOSITIONS WITH IMPROVED FLAVOR The Procter and Gamble Company (US) 2013-08-07 EP claimed
WO-2012091154-A1 METHOD OF PRODUCING A HYDROLYZABLE SILICON-CONTAINING COMPOUND WASEDA UNIVERSITY (JP) 2012-07-05 WO claimed
WO-2012044728-A1 ORAL CARE COMPOSITIONS WITH IMPROVED FLAVOR THE PROCTER & GAMBLE COMPANY (US) 2012-04-05 WO claimed
US-20120082628-A1 Oral Care Compositions With Improved Flavor THE PROCTER & GAMBLE COMPANY 2012-04-05 US claimed
US-4617401-A ANTISPASMODIC AGENTS, VASODILATORS SUNTORY LTD. (JP) 1986-10-14 US claimed
EP-0039903-B1 8-SUBSTITUTED PYRROLIZIDINES AND QUATERNARY AMMONIUM SALTS THEREOF SUNTORY KABUSHIKI KAISHA (JP) 1986-04-09 EP claimed
US-4315986-A DIPHENYMETHANE NUCLEATING AGENTS EASTMAN KODAK COMPANY (US) 1982-02-16 US claimed
EP-0039903-A2 8-Substituted pyrrolizidines and quaternary ammonium salts thereof SUNTORY KABUSHIKI KAISHA (JP) 1981-11-18 EP claimed
US-20250215582-A1 ELECTROCHEMICAL REACTOR AND PROCESSES USING THE ELECTROCHEMICAL REACTOR Karl-Franzens-Universität Graz (AT) 2025-07-03 US disclosed
EP-3383502-B1 ORAL CARE PRODUCT AND METHODS OF USE AND MANUFACTURE THEREOF COLGATE PALMOLIVE CO (US) 2025-03-05 EP disclosed
EP-4499895-A2 ELECTROCHEMICAL REACTOR AND PROCESSES USING THE ELECTROCHEMICAL REACTOR Karl-Franzens-Universität Graz (AT) 2025-02-05 EP disclosed
US-20240399360-A1 DEVICES AND METHODS FOR CREATING TRANSCELLULAR PORES GEORGIA TECH RES INST (US) 2024-12-05 US disclosed
US-4049823-A Phenylbutanol derivatives and compositions containing them MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1977-09-20 US disclosed
US-4001279-A CARRY INSOLUBLE REAGENT SUBSTANCES INTO SOLUTION IN NON-HYDROXYLIC MEDIA; CROWN COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1977-01-04 US disclosed
US-3965116-A COMPLEXING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1976-06-22 US disclosed
US-3959475-A ANTIDEPRESSANT, TRANQUILIZER, ANALGESIC AMERICAN HOECHST CORPORATION (US) 1976-05-25 US disclosed
US-3957828-A 3-Aminoalkyl-1,3-dihydro-3-phenylspiro[isobenzofurans] AMERICAN HOECHST CORPORATION (US) 1976-05-18 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 (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-20210130408-A1 COMPOUND AND METHOD FOR PRODUCING THE SAME DAO, DNPEP, DCXR IDO1 1339/4885TDO2 520/4885SCN1A 4849/4885
US-20120082628-A1 Oral Care Compositions With Improved Flavor TRPA1, TAS2R40, TAS2R30 IDO1 1565/4885TDO2 827/4885SCN1A 368/4885

“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.