Khellin

Khellin

SCHEMBL9655

COc1c2occc2c(OC)c2c(=O)cc(C)oc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 1.00
CYP1A1 P04798 3/20 1.00
HPGD P15428 3/20 1.00
MAPK1 P28482 3/20 1.00
CYP1A2 P05177 3/20 1.00
CYP1B1 Q16678 2/20 1.00
ALDH1A1 P00352 2/20 1.00
CYP2D6 P10635 2/20 1.00
PDE4A P27815 2/20 1.00
CYP2C19 P33261 2/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
KCNA3 P22001 6/20 0.69
MAPT P10636 1/20 0.68
ADORA3 P0DMS8 2/20 0.63
THRB P10828 1/20 0.63
KDM4E B2RXH2 1/20 0.55
POLB P06746 1/20 0.55
ALOX15 P16050 1/20 0.50
PTGS1 P23219 2/20 0.47
PTGS2 P35354 2/20 0.47

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
Khellin SCHEMBL30839911 1.00 CYP3A4 (1.00) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL3609628 0.90 CYP3A4 (0.82) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL10300856 0.90 CYP3A4 (0.82) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL13920849 0.90 CYP3A4 (0.81) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL13920848 0.90 CYP3A4 (0.81) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL1343992 0.88 CYP3A4 (0.78) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL1344606 0.88 CYP3A4 (0.78) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL12133429 0.88 CYP3A4 (0.77) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL12132138 0.87 CYP1A1 (0.76) CYP3A4CYP1A1HPGDMAPK1CYP1A2
SCHEMBL1344680 0.87 CYP3A4 (0.76) CYP3A4CYP1A1HPGDMAPK1CYP1A2

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

Appears in 35401 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260096569-A1 EDIBLE COATING WITH ANTIMICROBIAL PROPERTIES APEEL TECH INC (US) 2026-04-09 US claimed
EP-4580751-A2 STORAGE STABLE FORMULATIONS OF SULFATED GLYCOSAMINOGLYCANS AND FRAGMENTS DERIVED THEREFROM FOR THE TREATMENT OF PAIN AND OTHER MEDICAL CONDITIONS Adora Animal Health Corporation (US) 2025-07-09 EP claimed
US-12303528-B2 Storage stable formulations of sulfated glycosaminoglycans and fragments derived therefrom for the treatment of pain and other medical conditions ADORA ANIMAL HEALTH CORPORATION (US) 2025-05-20 US claimed
EP-4496476-A1 GAS PHASE TREATMENT OF PRODUCE Apeel Technology, Inc. (US) 2025-01-29 EP claimed
US-20240342208-A1 STORAGE STABLE FORMULATIONS OF SULFATED GLYCOSAMINOGLYCANS AND FRAGMENTS DERIVED THEREFROM FOR THE TREATMENT OF PAIN AND OTHER MEDICAL CONDITIONS ADORA LIFE SCIENCE, INC. 2024-10-17 US claimed
US-20240238278-A1 Pharmaceutical Composition for Preventing or Treating Fibrosis DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2024-07-18 US claimed
CN-118354793-A Methods and compositions for treating eosinophil-driven diseases and conditions 普瑞诺生物科技公司 2024-07-16 CN claimed
US-20240228540-A1 COMPOSITIONS AND METHODS FOR TREATING ENDOMETRIOSIS ENDOMET BIOSCIENCES, INC. 2024-07-11 US claimed
US-20240228583-A1 ACTIVIN RECEPTOR TYPE II CHIMERAS AND METHODS OF USE THEREOF KEROS THERAPEUTICS, INC. 2024-07-11 US claimed
US-20240216316-A1 DIHOMO-GAMMA LINOLENIC ACID (DGLA) IS A NOVEL SENOLYTIC BUCK INST RES AGING (US) 2024-07-04 US claimed
EP-0339054-A1 MIXTURE OF SUBSTANCES FOR STABILYZING METABOLISM. BILAS ANDOR 1989-11-02 EP claimed
EP-0328255-A1 A medicament for the treatment of a fibrotic disorder, and anti-fibrotic composition BAKER CUMMINS DERMATOLOGICALS, INC. (US) 1989-08-16 EP claimed
WO-1989003213-A1 MIXTURE OF SUBSTANCES FOR STABILYZING METABOLISM BILAS ANDOR (AT) 1989-04-20 WO claimed
EP-0308500-A1 HUMAN SOMATOMEDIN CARRIER PROTEIN SUBUNITS AND PROCESS FOR PRODUCING THEM. BIOGROWTH INC (US) 1989-03-29 EP claimed
EP-0301371-A2 Benzofuran carboxamides with basic substituents, process for their preparation and therapeutical compositions containing them BASF Aktiengesellschaft (DE) 1989-02-01 EP claimed
EP-0294021-A1 Human somatomedin carrier protein subunits and process for producing them BIOGROWTH, INC. (US) 1988-12-07 EP claimed
WO-1988007863-A1 HUMAN SOMATOMEDIN CARRIER PROTEIN SUBUNITS AND PROCESS FOR PRODUCING THEM BIOGROWTH, INC. (US) 1988-10-20 WO claimed
US-4524065-A Method for the prevention and treatment of scars with enzymes BIO-SPECIFICS N.V. (AN) 1985-06-18 US claimed
US-4399146-A Treatment of atherosclerosis with khellin-related furochromones THE UPJOHN COMPANY (US) 1983-08-16 US claimed
US-4281013-A Antiatherosclerotic use of khellin and khellinin THE UPJOHN COMPANY (US) 1981-07-28 US claimed