SCHEMBL443938

SCHEMBL443938

Clc1cccc2cc[nH]c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 1.00
NOS1 P29475 1/20 0.52
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
KEAP1 Q14145 1/20 0.48
PDPK1 O15530 1/20 0.47
TNF P01375 1/20 0.47
RIPK1 Q13546 1/20 0.47
NR3C1 P04150 1/20 0.43
PGR P06401 1/20 0.43
NR3C2 P08235 1/20 0.43
AR P10275 1/20 0.43
PSMB8 P28062 1/20 0.42
GRM5 P41594 1/20 0.41
TRPA1 O75762 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
ITGB2 P05107 1/20 0.41
ICAM1 P05362 1/20 0.41
ITGAL P20701 1/20 0.41

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
Indole SCHEMBL7216540 0.88 AHR (0.78) AHRNOS1CA12CA9KEAP1
Formic Acid SCHEMBL28403706 0.88 AHR (0.78) AHRNOS1CA12CA9KEAP1
Acetic Acid SCHEMBL27461652 0.87 AHR (0.75) AHRNOS1CA12CA9KEAP1
Formic Acid Methyl Ester SCHEMBL28167541 0.84 AHR (0.70) AHRNOS1CA12CA9KEAP1
SCHEMBL10463771 0.83 AHR (0.70) AHRNOS1CA12CA9KEAP1
SCHEMBL7089560 0.81 AHR (0.68) AHRCA12CA9KEAP1PDPK1
Quinoline SCHEMBL27753517 0.81 AHR (0.66) AHRNOS1CA12CA9KEAP1
Tert-Butyl Formate SCHEMBL27751459 0.80 AHR (0.64) AHRNOS1CA12CA9KEAP1
Ethoxycarbonyl Group SCHEMBL28003566 0.79 AHR (0.62) AHRNOS1CA12CA9KEAP1
SCHEMBL9119045 0.78 KEAP1 (0.62) AHRCA12CA9KEAP1PDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120131638-A Application of indole compound with electron withdrawing group in inhibiting plasmid conjugation transfer 扬州大学 2025-06-13 CN claimed
EP-4526426-A2 METHODS FOR PRODUCING MONOTERPENE INDOLE ALKALOIDS Danmarks Tekniske Universitet (DK) 2025-03-26 EP claimed
CN-118667802-A Method for improving stability of horseradish peroxidase 伊莱瑞特(武汉)生物技术有限公司 2024-09-20 CN claimed
CN-118125960-A Bisindole 3-ketone compound, application and preparation method thereof 云南农业大学 2024-06-04 CN claimed
CN-118063373-A 3,3' -Bisindole compound and application and preparation method thereof 云南农业大学 2024-05-24 CN claimed
WO-2023222879-A2 METHODS FOR PRODUCING MONOTERPENE INDOLE ALKALOIDS DANMARKS TEKNISKE UNIVERSITET (DK) 2023-11-23 WO claimed
CN-114805664-B Bionic modified marine antifouling resin material, and preparation method and application thereof 江苏苏博特新材料股份有限公司 2023-04-14 CN claimed
CN-114805664-A Bionic modified marine antifouling resin material, and preparation method and application thereof 江苏苏博特新材料股份有限公司 2022-07-29 CN claimed
CN-114292582-B Hyperbranched coating suitable for marine concrete, and preparation method and application thereof 江苏苏博特新材料股份有限公司 2022-07-12 CN claimed
CN-114292582-A Hyperbranched coating suitable for marine concrete, and preparation method and application thereof 江苏苏博特新材料股份有限公司 2022-04-08 CN claimed
CN-110372722-B Method for synthesizing sulfur-nitrogen-containing bis-heterocyclic compound 河南师范大学 2020-08-11 CN claimed
CN-111004283-A Preparation method of 3-phosphoryl indole compound 南京理工大学 2020-04-14 CN claimed
CN-106117113-A Polysubstituted carbazole, derivant and synthetic method thereof 湘潭大学 2016-11-16 CN claimed
CN-104073045-A Application of halogenated indole and derivatives thereof as marine antifouling agent YANTAI INST COASTAL ZONE RES CAS 2014-10-01 CN claimed
CN-1451002-A Indole derivatives for treating central nervous system disease LUNDBECK & CO AS H (DK) 2003-10-22 CN claimed
US-20260071243-A1 BIOLOGICAL PRODUCTION OF TRYPTOPHAN-DERIVED PRODUCTS UNIV TEXAS (US) 2026-03-12 US disclosed
EP-3897833-B1 INHIBITORS OF APOL1 AND METHODS OF USING SAME VERTEX PHARMA (US) 2026-02-04 EP disclosed
WO-1994021627-A1 INDOLE DERIVATIVES AS DOPAMINE D4 ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 1994-09-29 WO disclosed
US-4731353-A METAL SALT OF INDOLE-2-CARBOXYLIC ACID COLOR DEVELOPER KANZAKI PAPER MANUFACTURING COMPANY, LIMITED (JP) 1988-03-15 US disclosed
EP-0116938-A1 Benzoheterocyclic carbamates USV PHARMACEUTICAL CORPORATION (US) 1984-08-29 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-20260071243-A1 BIOLOGICAL PRODUCTION OF TRYPTOPHAN-DERIVED PRODUCTS TPH1, TPH2, SLC6A4 AHR 148/4885NOS1 980/4885CA12 3187/4885

“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.