SCHEMBL1108372

SCHEMBL1108372

COc1ccc2oc(=O)ccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 1.00
CA9 Q16790 9/20 0.77
CA12 O43570 8/20 0.77
CA1 P00915 4/20 0.77
ALDH1A1 P00352 3/20 0.77
CA4 P22748 2/20 0.77
KDM4E B2RXH2 2/20 0.77
AKR1B1 P15121 2/20 0.77
HPGD P15428 2/20 0.77
CA7 P43166 2/20 0.77
HSD17B10 Q99714 2/20 0.77
CA3 P07451 1/20 0.77
CA6 P23280 1/20 0.77
CA5A P35218 1/20 0.77
CA14 Q9ULX7 1/20 0.77
MCL1 Q07820 2/20 0.62
ACHE P22303 3/20 0.61
PKM P14618 1/20 0.59
PDE3B Q13370 1/20 0.58
PDE3A Q14432 1/20 0.58

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
Acetaldehyde SCHEMBL28028617 0.93 CYP2A6 (0.87) CYP2A6CA9CA12CA1ALDH1A1
SCHEMBL23114201 0.88 CYP2A6 (0.77) CYP2A6CA9CA12CA1ALDH1A1
Herniarin SCHEMBL17629468 0.87 CA12 (1.00) CYP2A6CA9CA12CA1ALDH1A1
Herniarin SCHEMBL29437733 0.87 CA12 (1.00) CYP2A6CA9CA12CA1ALDH1A1
Herniarin SCHEMBL61221 0.87 CA12 (1.00) CYP2A6CA9CA12CA1ALDH1A1
SCHEMBL29001886 0.86 CYP2A6 (0.76) CYP2A6CA9CA12CA1ALDH1A1
SCHEMBL30450765 0.86 CYP2A6 (0.76) CYP2A6CA9CA12CA1ALDH1A1
Herniarin SCHEMBL17113785 0.85 CA12 (0.96) CYP2A6CA9CA12CA1ALDH1A1
SCHEMBL29001885 0.83 CYP2A6 (0.71) CYP2A6CA9CA12CA1ALDH1A1
SCHEMBL28011620 0.82 CYP2A6 (0.68) CYP2A6CA9CA12CA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107922968-A Nucleotide for the polymeric marker of unimolecule electronics SNP measure 哥伦比亚大学董事会 2018-04-17 CN claimed
US-9127092-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2015-09-08 US claimed
US-20140187725-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2014-07-03 US claimed
EP-0022188-B1 CO-INITIATOR COMPOSITIONS FOR PHOTOPOLYMERIZATION CONTAINING 3-ACYL-SUBSTITUTED COUMARINS, PHOTOPOLYMERIZABLE COMPOSITION AND PHOTOGRAPHIC ELEMENT EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1984-10-03 EP claimed
US-20260102327-A1 COSMETIC COMPOSITION FOR SKIN IMPROVEMENT CONTAINING LOW-MOLECULAR-WEIGHT COLLAGEN, COLLAGEN WATER, OR COLLAGEN EXTRACT SOOY-K CO., LTD. (KR) 2026-04-16 US disclosed
US-12408914-B2 Systems and methods for customizing mechanical strength in stimuli-responsive bioabsorbable materials CILAG GMBH INTERNATIONAL (CH) 2025-09-09 US disclosed
EP-4543502-A1 SYSTEMS AND METHODS FOR CUSTOMIZING MECHANICAL STRENGTH IN STIMULI-RESPONSIVE BIOABSORBABLE MATERIALS Cilag GmbH International (CH) 2025-04-30 EP disclosed
US-20240423617-A1 SYSTEMS AND METHODS FOR CUSTOMIZING MECHANICAL STRENGTH IN STIMULI-RESPONSIVE BIOABSORBABLE MATERIALS CILAG GMBH INTERNATIONAL (CH) 2024-12-26 US disclosed
US-20240423620-A1 COMPRESSIBLE SURGICAL ADJUNCTS, CARTRIDGES, AND CARTRIDGE ASSEMBLIES AND METHODS OF MAKING SURGICAL ADJUNCTS CILAG GMBH INTERNATIONAL (CH) 2024-12-26 US disclosed
WO-2024261659-A1 SYSTEMS AND METHODS FOR CUSTOMIZING MECHANICAL STRENGTH IN STIMULI-RESPONSIVE BIOABSORBABLE MATERIALS CILAG GMBH INTERNATIONAL (CH) 2024-12-26 WO disclosed
US-20240200081-A1 NUCLEIC ACID MOLECULE CONJUGATE HAVING PROLONGED IN VIVO HALF-LIFE Aptacure Therapeutics Limited (CN) 2024-06-20 US disclosed
EP-4303307-A1 METHOD FOR PRODUCING FLAVOURS USING O-METHYLTRANSFERASE FROM PLEUROTUS Justus-Liebig-Universität Gießen Rechtsabteilung (DE) 2024-01-10 EP disclosed
EP-0695753-A1 Carbapenem derivatives containing a bicyclic substituent, process for their preparation, and their use ZENECA LIMITED (GB) 1996-02-07 EP disclosed
EP-0489778-A1 ANTI-INFLAMMATORY ACTIVE INGREDIENTS FOR COSMETIC PREPARATIONS Henkel Kommanditgesellschaft auf Aktien (DE) 1992-06-17 EP disclosed
WO-1991003232-A1 ANTI-INFLAMMATORY ACTIVE INGREDIENTS FOR COSMETIC PREPARATIONS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1991-03-21 WO disclosed
WO-1991002515-A1 ANTI-INFLAMMATORY SUBSTANCES FOR COSMETIC PREPARATION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1991-03-07 WO disclosed
WO-1991002514-A1 ANTI-INFLAMMATORY ACTIVE SUBSTANCES FOR COSMETIC COMPOSITIONS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1991-03-07 WO disclosed
EP-0370282-A2 Anti-inflammatory compounds for cosmetic preparations Henkel Kommanditgesellschaft auf Aktien (DE) 1990-05-30 EP disclosed
WO-1990004958-A1 ANTI-INFLAMMATORY ACTIVE INGREDIENTS FOR COSMETIC PREPARATIONS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1990-05-17 WO disclosed
US-4441969-A ARYL HYDROXY CARBOXYLIC ACID OMI INTERNATIONAL CORPORATION (US) 1984-04-10 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-20240200081-A1 NUCLEIC ACID MOLECULE CONJUGATE HAVING PROLONGED IN VIVO HALF-LIFE SOST, FABP1, VEGFA CYP2A6 1334/4885CA9 896/4885CA12 828/4885
US-20260102327-A1 COSMETIC COMPOSITION FOR SKIN IMPROVEMENT CONTAINING LOW-MOLECULAR-WEIGHT COLLAGEN, COLLAGEN WATER, OR COLLAGEN EXTRACT COL2A1, COL14A1, COL1A1 CYP2A6 2472/4885CA9 135/4885CA12 388/4885

“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.