SCHEMBL4576605

SCHEMBL4576605

COc1cc(C(=O)O)cc(OC)c1C(C)C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.62
CA1 P00915 2/20 0.62
CA2 P00918 2/20 0.62
CA4 P22748 2/20 0.62
CA6 P23280 2/20 0.62
CA7 P43166 2/20 0.62
CA9 Q16790 2/20 0.62
CA14 Q9ULX7 2/20 0.62
CA3 P07451 1/20 0.62
PKM P14618 1/20 0.62
CA5A P35218 1/20 0.62
CA5B Q9Y2D0 1/20 0.62
PTGS2 P35354 1/20 0.58
TPMT P51580 2/20 0.55
HTT P42858 2/20 0.52
CNR2 P34972 1/20 0.51
TSHR P16473 3/20 0.47
MAPK1 P28482 2/20 0.46
LMNA P02545 2/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL11774612 0.85 CA12 (0.58) CA12CA1CA2CA4CA6
SCHEMBL2937093 0.82 CA12 (0.41) CA12CA1CA2CA4CA6
SCHEMBL917818 0.82 MAPT (0.50) CA12CA1CA2CA7CA9
SCHEMBL4576891 0.82 CA12 (0.41) CA12CA1CA2CA4CA6
SCHEMBL10317501 0.82 CA12 (0.60) CA12CA1CA2CA4CA6
SCHEMBL29149126 0.81 PTGS2 (0.48) CA12CA1CA2CA4CA6
SCHEMBL2937498 0.81 KDM4E (0.58) CA12CA1CA2CA4CA6
SCHEMBL31556009 0.79 CA12 (0.56) CA12CA1CA2CA4CA6
SCHEMBL4576550 0.79 CXCL12 (0.52) CA12CA1CA2CA4CA6
SCHEMBL4576554 0.79 CXCL12 (0.52) CA12CA1CA2CA4CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119504367-A Preparation method of benvimod 承德医学院 2025-02-25 CN claimed
CN-117105768-A Preparation method of 4-isopropyl 3, 5-dimethoxy benzoic acid 承德医学院 2023-11-24 CN claimed
CN-122029153-A Aromatic hydrocarbon receptor modulator compound, and preparation method and application thereof 德明药泰生物技术(深圳)有限公司 2026-05-12 CN disclosed
US-20260091027-A1 STILBENE DERIVATIVES AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF THEDERMA SHANGHAI CO LTD (CN) 2026-04-02 US disclosed
EP-4592271-A1 STILBENE DERIVATIVES AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF Thederma Shanghai Co., Ltd. (CN) 2025-07-30 EP disclosed
WO-2025082312-A1 AROMATIC HYDROCARBON RECEPTOR MODULATOR COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 德明药泰生物技术(深圳)有限公司 2025-04-24 WO disclosed
CN-119504367-A Preparation method of benvimod 承德医学院 2025-02-25 CN disclosed
CN-118317952-A Heterocyclic substituted phenol derivatives, process for their preparation and their use 上海泽德曼医药科技有限公司 2024-07-09 CN disclosed
CN-118139837-A Stilbene derivative, preparation method and application thereof 上海泽德曼医药科技有限公司 2024-06-04 CN disclosed
CN-118084629-A Styrene compound, preparation method and medical application thereof 上海泽德曼医药科技有限公司 2024-05-28 CN disclosed
CN-116947799-B Phenolic compound, preparation method and medical application thereof 上海泽德曼医药科技有限公司 2024-05-03 CN disclosed
WO-2024078372-A1 HETEROCYCLIC SUBSTITUTED PHENOL DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 上海泽德曼医药科技有限公司 2024-04-18 WO disclosed
WO-2024061187-A1 STILBENE DERIVATIVES AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF 上海泽德曼医药科技有限公司 2024-03-28 WO disclosed
CN-117447402-A Aromatic hydrocarbon receptor modulator compound, and preparation method and application thereof 德明药泰生物技术(深圳)有限公司 2024-01-26 CN disclosed
CN-117105768-A Preparation method of 4-isopropyl 3, 5-dimethoxy benzoic acid 承德医学院 2023-11-24 CN disclosed
CN-117105768-A Preparation method of 4-isopropyl 3, 5-dimethoxy benzoic acid 承德医学院 2023-11-24 CN disclosed
CN-117105768-A Preparation method of 4-isopropyl 3, 5-dimethoxy benzoic acid 承德医学院 2023-11-24 CN disclosed
CN-116947799-A Phenolic compound, preparation method and medical application thereof 上海泽德曼医药科技有限公司 2023-10-27 CN disclosed
CN-111217681-A Anti-inflammatory compounds and uses thereof 福州百草堂医药科技有限公司 2020-06-02 CN disclosed
US-20080255245-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxystilbenes and Novel Stilbene Derivatives and Analogues WELICHEM BIOTECH INC. (CA) 2008-10-16 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 (2 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-20080255245-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxystilbenes and Novel Stilbene Derivatives and Analogues NFKBIA, IKBKB, IKBKE CA12 4789/4885CA1 4802/4885CA2 3883/4885
US-20260091027-A1 STILBENE DERIVATIVES AS WELL AS PREPARATION METHOD THEREFOR AND USE THEREOF AHR, CYP1B1, ARNT CA12 3341/4885CA1 3590/4885CA2 1558/4885

“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.