Sugi Predict

Sugi Predict / Compounds / SCHEMBL57411

SCHEMBL57411

SCHEMBL57411

CC(C)(CC(=O)O)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 2/20 0.69
▸ HIF1A Q16665 2/20 0.69
▸ TAAR1 Q96RJ0 1/20 0.52
▸ ALDH1A1 P00352 3/20 0.50
▸ HTT P42858 1/20 0.50
▸ MAPT P10636 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ ME2 P23368 2/20 0.46
▸ ME1 P48163 2/20 0.46
▸ ME3 Q16798 2/20 0.46
▸ HDAC3 O15379 1/20 0.45
▸ HDAC4 P56524 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC7 Q8WUI4 1/20 0.45
▸ HDAC2 Q92769 1/20 0.45
▸ HDAC10 Q969S8 1/20 0.45
▸ HDAC11 Q96DB2 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ HDAC6 Q9UBN7 1/20 0.45
▸ HDAC9 Q9UKV0 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
Hydrochloric Acid SCHEMBL29090142 0.98 CYP2C19 (0.67) CYP2C19HIF1ATAAR1ALDH1A1HTT
Hydrochloric Acid SCHEMBL22345946 0.96 CYP2C19 (0.64) CYP2C19HIF1ATAAR1ALDH1A1HTT
Aluminum Chloride Anhydrous SCHEMBL22345947 0.92 CYP2C19 (0.60) CYP2C19HIF1ATAAR1ALDH1A1HTT
SCHEMBL7014527 0.90 CYP2C19 (0.58) CYP2C19HIF1ATAAR1ALDH1A1HTT
SCHEMBL7739108 0.89 CYP2C19 (0.61) CYP2C19HIF1ATAAR1ALDH1A1HTT
SCHEMBL1850 0.84 CYP2C19 (0.55) CYP2C19HIF1ATAAR1ALDH1A1HTT
SCHEMBL10914051 0.84 CYP2C19 (0.50) CYP2C19HIF1AALDH1A1MAPTHMGCR
SCHEMBL24619681 0.84 CYP2C19 (0.60) CYP2C19HIF1ATAAR1ALDH1A1HTT
SCHEMBL5990790 0.83 ESR1 (0.56) CYP2C19HIF1AALDH1A1ME2ME1
SCHEMBL3485439 0.83 CYP2C19 (0.48) CYP2C19HIF1AALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118754873-B Cyclobutane indole derivative and preparation method and application thereof 广东医科大学 2025-03-07 — — CN claimed
CN-102911027-A Method for preparing indanone SHANGHAI YONGHONG INDUSTRY GROUP CHEMICAL TECHNOLOGY CO LTD 2013-02-06 — — CN claimed
US-20260034094-A1 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS KOJIN THERAPEUTICS INC (US) 2026-02-05 — — US disclosed
US-12466805-B2 Pharmaceutical compounds ALMAC DISCOVERY LIMITED (GB) 2025-11-11 — — US disclosed
EP-4565228-A2 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS Kojin Therapeutics, Inc. (US) 2025-06-11 — — EP disclosed
US-12312419-B2 Hemiasterlin derivative having cysteine residue Sumitomo Pharma Co., Ltd. (JP) 2025-05-27 — — US disclosed
US-12303544-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same ZYMEWORKS BC INC. (CA) 2025-05-20 — — US disclosed
CN-118754873-B Cyclobutane indole derivative and preparation method and application thereof 广东医科大学 2025-03-07 — — CN disclosed
US-12178879-B2 Hemiasterlin derivative and antibody-drug conjugate thereof Sumitomo Pharma Co., Ltd. (JP) 2024-12-31 — — US disclosed
CN-113412271-B Having cysteine residues Hamiltelin derivatives of (C) 住友制药株式会社 2024-10-22 — — CN disclosed
CN-118787062-A Rosa roxburghii and coix seed beverage and preparation method thereof 贵州大学 2024-10-18 — — CN disclosed
EP-0488616-A1 Indane and quinoline derivatives E.R. SQUIBB & SONS, INC. (US) 1992-06-03 — — EP disclosed
WO-1992008688-A1 RETROVIRAL PROTEASE INHIBITORS MONSANTO COMPANY (US) 1992-05-29 — — WO disclosed
US-5087289-A ALKANOIC ACID DERIVATIVES AND HERBICIDAL COMPOSITIONS KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1992-02-11 — — US disclosed
US-4987132-A PLATELET ACTIVATING FACTOR ANTAGONISTS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-01-22 — — US disclosed
US-4968340-A PREEMERGENCE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1990-11-06 — — US disclosed
EP-0347811-A1 Alkanoic acid derivatives and herbicidal compositions KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-12-27 — — EP disclosed
US-4837201-A 4-Methyl-4-phenyl-1-pentanals, their preparation and their use as scents BASF AKTIENGESELLSCHAFT (DE) 1989-06-06 — — US disclosed
EP-0307837-A2 Renin-inhibiting peptidyl heterocycles ABBOTT LABORATORIES (US) 1989-03-22 — — EP disclosed
EP-0009637-A1 Alpha-phenyl-alpha-isopropyl acetates, process for their preparation, pesticides containing them and the use of these acetates in the control of pests CIBA-GEIGY AG (CH) 1980-04-16 — — 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 (5 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-12466805-B2 Pharmaceutical compounds USP19, USP18, UBE2I CYP2C19 162/4885HIF1A 2519/4885TAAR1 4742/4885
US-12312419-B2 Hemiasterlin derivative having cysteine residue SHBG, CYP11A1, CYP11B1 CYP2C19 1858/4885HIF1A 1499/4885TAAR1 3598/4885
US-12303544-B2 Cytotoxic and anti-mitotic compounds, and methods of using the same CCNB1, PLK1, BOD1L1 CYP2C19 4458/4885HIF1A 4754/4885TAAR1 4759/4885
US-12178879-B2 Hemiasterlin derivative and antibody-drug conjugate thereof SHBG, HSD17B7, CYP17A1 CYP2C19 725/4885HIF1A 1316/4885TAAR1 3939/4885
US-20260034094-A1 COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS AIFM2, GPX4, HMOX1 CYP2C19 4852/4885HIF1A 326/4885TAAR1 2119/4885

“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.