SCHEMBL5605676

SCHEMBL5605676

Cc1ccc(CCS)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 1/20 0.62
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2A6 P11509 1/20 0.56
▸ TAAR1 Q96RJ0 1/20 0.56
▸ KCNH2 Q12809 2/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.45
▸ TDP1 Q9NUW8 2/20 0.44
▸ ACHE P22303 1/20 0.44
▸ IGF1R P08069 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ AGXT P21549 2/20 0.42
▸ CHKA P35790 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HRH1 P35367 1/20 0.39
▸ FFAR1 O14842 1/20 0.39
▸ DAO P14920 1/20 0.38
▸ MAPT P10636 1/20 0.38

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
SCHEMBL2158412 0.93 IDO1 (0.54) IDO1CYP1A2CYP2A6TAAR1KCNH2
SCHEMBL332100 0.85 GFER (0.42) IDO1CYP1A2CYP2A6TAAR1HRH3
SCHEMBL5609061 0.84 IDO1 (0.56) IDO1CYP1A2CYP2A6TAAR1KCNH2
SCHEMBL5610023 0.82 IDO1 (0.54) IDO1CYP1A2CYP2A6TAAR1KCNH2
SCHEMBL143961 0.82 CYP1A2 (0.68) IDO1CYP1A2CYP2A6TAAR1KCNH2
SCHEMBL11288839 0.82 CYP1A2 (0.68) IDO1CYP1A2CYP2A6TAAR1KCNH2
SCHEMBL12125077 0.80 IDO1 (0.52) IDO1CYP1A2CYP2A6TAAR1KCNH2
SCHEMBL2158616 0.79 IDO1 (0.50) IDO1CYP1A2CYP2A6TAAR1KCNH2
SCHEMBL9172811 0.78 TAAR1 (0.56) IDO1CYP2A6TAAR1HRH3TDP1
SCHEMBL10839974 0.78 LPL (0.50) TAAR1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115219473-B Self-assembled two-dimensional super-surface material based on post-modified silver polyhedral particles, and preparation method and application thereof 天津师范大学 2024-04-23 — — CN disclosed
EP-2711381-B1 NOVEL COMPOUND, COMPOSITION CONTAINING SAID COMPOUND, AND CURED PRODUCT MITSUI CHEMICALS INC (JP) 2020-02-05 — — EP disclosed
WO-2017193017-A1 ANTIMICROBIALS AND METHODS OF MAKING AND USING SAME MELINTA THERAPEUTICS, INC. (US) 2017-11-09 — — WO disclosed
EP-2137179-B1 PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS MERCK SHARP & DOHME (US) 2015-09-02 — — EP disclosed
WO-2012085081-A1 SULFOXIMINAMIDE COMPOUNDS FOR COMBATING INVERTEBRATE PESTS II BASF SE (DE) 2012-06-28 — — WO disclosed
US-7862868-B2 Ink-jet recording material FERRANIA TECHNOLOGIES, S.P.A. (IT) 2011-01-04 — — US disclosed
US-20080138544-A1 Ink-Jet Recording Material FERRANIA TECHNOLOGIES, S.P.A. 2008-06-12 — — US disclosed
EP-1803758-A1 POLYEPOXY COMPOUND, METHOD FOR PRODUCING SAME, THERMOSETTING RESIN COMPOSITION CONTAINING SAME, CURED PRODUCT OF SUCH COMPOSITION, AND METHOD FOR REMOVING SUCH CURED PRODUCT KANSAI PAINT CO., LTD. (JP) 2007-07-04 — — EP disclosed
US-7199139-B2 Medicinal compositions containing diuretic and insulin resistance-improving agent SANKYO COMPANY, LIMITED (JP) 2007-04-03 — — US disclosed
EP-1761485-A1 AMIDINO COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS Schering AG (DE) 2007-03-14 — — EP disclosed
EP-1354602-A1 MEDICINAL COMPOSITIONS CONTAINING DIURETIC AND INSULIN RESISTANCE-IMPROVING AGENT Sankyo Company, Limited (JP) 2003-10-22 — — EP disclosed
EP-0916651-B1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES SANKYO CO (JP) 2003-10-15 — — EP disclosed
WO-2002018404-A9 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C HOFFMANN LA ROCHE (CH) 2003-10-02 — — WO disclosed
EP-1315736-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2003-06-04 — — EP disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 — — US disclosed
US-20030008841-A1 Anti-HCV nucleoside derivatives F. HOFFMAN-LA ROCHE, A SWISS COMPANY (CH) 2003-01-09 — — US disclosed
WO-2002018404-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2002-03-07 — — WO disclosed
US-6103907-A ALDOSE REDUCTASE INHIBITING ANTIDIABETIC AGENT SANKYO COMPANY, LIMITED (JP) 2000-08-15 — — US disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 — — EP disclosed
EP-0916651-A1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 1999-05-19 — — 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 (1 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-20030008841-A1 Anti-HCV nucleoside derivatives PNP, HAVCR2, NUDT14 IDO1 1985/4885CYP1A2 3228/4885CYP2A6 2754/4885

“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.

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