Sugi Predict

Sugi Predict / Compounds / SCHEMBL25199285

SCHEMBL25199285

SCHEMBL25199285

COc1cc(/C=C/c2ccccc2)cc(OC)n1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 1/20 0.65
▸ TUBB1 Q9H4B7 2/20 0.58
▸ TUBB4A P04350 1/20 0.58
▸ TUBB P07437 1/20 0.58
▸ TUBA3C P0DPH7 1/20 0.58
▸ TUBA1B P68363 1/20 0.58
▸ TUBA4A P68366 1/20 0.58
▸ TUBB4B P68371 1/20 0.58
▸ TUBB3 Q13509 1/20 0.58
▸ TUBB2A Q13885 1/20 0.58
▸ TUBB8 Q3ZCM7 1/20 0.58
▸ TUBA3E Q6PEY2 1/20 0.58
▸ TUBA1A Q71U36 1/20 0.58
▸ TUBA1C Q9BQE3 1/20 0.58
▸ TUBB6 Q9BUF5 1/20 0.58
▸ TUBB2B Q9BVA1 1/20 0.58
▸ TRPA1 O75762 2/20 0.55
▸ ALDH1A1 P00352 3/20 0.55
▸ KDM4E B2RXH2 2/20 0.55
▸ HPGD P15428 2/20 0.55

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
SCHEMBL25180830 0.89 GRM4 (0.55) GRM4TUBB1TUBB4ATUBBTUBA3C
SCHEMBL25181917 0.88 GRM4 (0.54) GRM4TUBB1TUBB4ATUBBTUBA3C
Hydrochloric Acid SCHEMBL4856091 0.85 GRM4 (0.58) GRM4TUBB1TUBB4ATUBBTUBA3C
SCHEMBL2955136 0.81 CYP1A2 (0.51) GRM4TUBB1TUBB4ATUBBTUBA3C
SCHEMBL2955141 0.81 CYP1A2 (0.51) GRM4TUBB1TUBB4ATUBBTUBA3C
SCHEMBL16597855 0.81 GRM4 (0.70) GRM4TUBB1TUBB4ATUBBTUBA3C
SCHEMBL16597852 0.81 GRM4 (0.70) GRM4TUBB1TUBB4ATUBBTUBA3C
3,5-O-Dimethylpinosylvin SCHEMBL918726 0.77 KDM4E (0.79) TUBB1TUBB4ATUBBTUBA3CTUBA1B
3,5-O-Dimethylpinosylvin SCHEMBL9419809 0.77 KDM4E (0.79) TUBB1TUBB4ATUBBTUBA3CTUBA1B
3,5-O-Dimethylpinosylvin SCHEMBL918727 0.77 KDM4E (0.79) TUBB1TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250136556-A1 NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF ALLIANTHERA BOSTON INC. 2025-05-01 — — US disclosed
CN-118748992-A Novel modulators of aryl hydrocarbon receptors and methods of use thereof 元启(苏州)生物制药有限公司 2024-10-08 — — CN disclosed
EP-4430028-A2 NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF Allianthera (Suzhou) Biopharmaceutical Co., Ltd. (CN) 2024-09-18 — — EP disclosed
WO-2023086428-A2 NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) 2023-05-19 — — WO disclosed
WO-2023086428-A2 NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF ALLIANTHERA (SUZHOU) BIOPHARMACEUTICAL CO., LTD. (CN) 2023-05-19 — — WO 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-20250136556-A1 NOVEL MODULATORS OF THE ARYL HYDROCARBON RECEPTOR AND METHODS OF USE THEREOF AHR, ARNT, NR1H2 GRM4 1348/4885TUBB1 4217/4885TUBB4A 4160/4885

“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.