SCHEMBL4068600

SCHEMBL4068600

c1ccc(Sc2c[nH]c3ccccc23)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 2/20 1.00
TUBB P07437 2/20 1.00
TUBA3C P0DPH7 2/20 1.00
TUBA1B P68363 2/20 1.00
TUBA4A P68366 2/20 1.00
TUBB4B P68371 2/20 1.00
TUBB3 Q13509 2/20 1.00
TUBB2A Q13885 2/20 1.00
TUBB8 Q3ZCM7 2/20 1.00
TUBA3E Q6PEY2 2/20 1.00
TUBA1A Q71U36 2/20 1.00
TUBA1C Q9BQE3 2/20 1.00
TUBB6 Q9BUF5 2/20 1.00
TUBB2B Q9BVA1 2/20 1.00
TUBB1 Q9H4B7 2/20 1.00
IDO1 P14902 5/20 0.61
GFER P55789 1/20 0.61
PGR P06401 1/20 0.53
HTR1A P08908 1/20 0.53
ADRA2A P08913 1/20 0.53

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
SCHEMBL34463637 0.98 TUBB4A (0.96) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL25356196 0.89 TUBB4A (0.80) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5307941 0.87 TUBB4A (0.77) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28515820 0.85 TUBB4A (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL22802294 0.85 TUBB4A (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29629604 0.85 TUBB4A (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5776244 0.85 TUBB4A (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL22802286 0.85 TUBB4A (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL7498794 0.85 TUBB4A (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL29988391 0.85 TUBB4A (0.74) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111100056-B Synthetic method for preparing 3-thiophenyl indole compound by oxygen oxidation without transition metal catalysis 浙江工业大学 2021-07-06 CN claimed
US-20200399217-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES CFD RESEARCH CORPORATION 2020-12-24 US claimed
US-20200399218-A1 ANTIMICROBIAL COMPOUNDS, COMPOSITIONS, AND ARTICLES OF MANUFACTURE FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES CFD RESEARCH CORPORATION 2020-12-24 US claimed
CN-111100056-A Synthetic method for preparing 3-thiophenyl indole compound by oxygen oxidation without transition metal catalysis 浙江工业大学 2020-05-05 CN claimed
US-20250382269-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES CFD RES CORPORATION (US) 2025-12-18 US disclosed
US-20250382268-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES CFD RES CORPORATION (US) 2025-12-18 US disclosed
US-12202798-B2 Antimicrobial compounds, compositions, and articles of manufacture for selectively inhibiting pathogenic microbes CFD RESEARCH CORPORATION (US) 2025-01-21 US disclosed
US-11180452-B2 Methods and compositions for selectively inhibiting pathogenic microbes CFD RESEARCH CORPORATION (US) 2021-11-23 US disclosed
US-11180452-B2 Methods and compositions for selectively inhibiting pathogenic microbes CFD RESEARCH CORPORATION (US) 2021-11-23 US disclosed
CN-111100056-B Synthetic method for preparing 3-thiophenyl indole compound by oxygen oxidation without transition metal catalysis 浙江工业大学 2021-07-06 CN disclosed
CN-108586312-B Green sulfuration method of indole compound by using triphosgene as reducing agent 丽水学院 2021-03-05 CN disclosed
US-20200399218-A1 ANTIMICROBIAL COMPOUNDS, COMPOSITIONS, AND ARTICLES OF MANUFACTURE FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES CFD RESEARCH CORPORATION 2020-12-24 US disclosed
US-20030232828-A1 1-(AMINOALKYL)-3-SULFONYLINDOLE AND-INDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH 2003-12-18 US disclosed
US-20030130337-A1 Indole derivatives as anti-inflammatory agents SYNTEX (U.S.A.) LLC 2003-07-10 US disclosed
EP-0924209-B1 Hypoglycemic imidazoline compounds LILLY CO ELI (US) 2003-05-02 EP disclosed
WO-2003029212-A1 INDOLE DERIVATIVES AS COX II INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2003-04-10 WO disclosed
EP-1266897-A2 Hypoglycemic imidazoline compounds ELI LILLY AND COMPANY (US) 2002-12-18 EP disclosed
US-6410562-B1 ANTIDIABETIC AGENTS ELI LILLY AND COMPANY 2002-06-25 US disclosed
EP-0924209-A1 Hypoglycemic imidazoline compounds ELI LILLY AND COMPANY (US) 1999-06-23 EP disclosed
US-4654360-A 1,2,3-trisubstituted indoles for treatment of inflammation SYNTEX (U.S.A.) INC. (US) 1987-03-31 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 (8 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-20030130337-A1 Indole derivatives as anti-inflammatory agents IDO1, IDO2, PTGS1 TUBB4A 2545/4885TUBB 2149/4885TUBA3C 2203/4885
US-12202798-B2 Antimicrobial compounds, compositions, and articles of manufacture for selectively inhibiting pathogenic microbes ZYX, IDO1, CRY1 TUBB4A 2312/4885TUBB 2695/4885TUBA3C 2269/4885
US-11180452-B2 Methods and compositions for selectively inhibiting pathogenic microbes FPR1, FPR3, ARG1 TUBB4A 2901/4885TUBB 2885/4885TUBA3C 2645/4885
US-20250382269-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES CD14, MIF, NOD2 TUBB4A 2340/4885TUBB 1711/4885TUBA3C 2384/4885
US-20200399217-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES FPR1, FPR3, ARG1 TUBB4A 2901/4885TUBB 2885/4885TUBA3C 2645/4885
US-20030232828-A1 1-(AMINOALKYL)-3-SULFONYLINDOLE AND-INDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS HTR6, HTR3A, HTR5A TUBB4A 1421/4885TUBB 813/4885TUBA3C 661/4885
US-20250382268-A1 METHODS AND COMPOSITIONS FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES CD14, MIF, NOD2 TUBB4A 2340/4885TUBB 1711/4885TUBA3C 2384/4885
US-20200399218-A1 ANTIMICROBIAL COMPOUNDS, COMPOSITIONS, AND ARTICLES OF MANUFACTURE FOR SELECTIVELY INHIBITING PATHOGENIC MICROBES ZYX, IDO1, CRY1 TUBB4A 2312/4885TUBB 2695/4885TUBA3C 2269/4885

“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.