SCHEMBL28415

SCHEMBL28415

[CH]1CCc2ccccc2O1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
TSHR P16473 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.35
ITGB2 P05107 1/20 0.35
ICAM1 P05362 1/20 0.35
ITGAL P20701 1/20 0.35
OXTR P30559 1/20 0.34
GAA P10253 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTR2C P28335 1/20 0.32
LMNA P02545 2/20 0.31
CRHBP P24387 2/20 0.31
CRHR2 Q13324 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HTT P42858 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
CA2 P00918 2/20 0.30

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
SCHEMBL338806 0.86 TSHR (0.44) MAOAMAOBTSHRABCG2ITGB2
SCHEMBL23362988 0.77 MAOA (0.38) MAOAMAOBTSHRABCG2ITGB2
SCHEMBL14591135 0.77 MAOA (0.38) MAOAMAOBTSHRABCG2ITGB2
SCHEMBL22439186 0.77 MAOA (0.38) MAOAMAOBTSHRABCG2ITGB2
SCHEMBL19859855 0.75
SCHEMBL533876 0.70 CHRNB2 (0.33) CA2
SCHEMBL2122942 0.70 SIGMAR1 (0.42) SIGMAR1
SCHEMBL20721930 0.70 AHR (0.40) NPSR1HTR2CSMN1; SMN2HTT
SCHEMBL2119376 0.70 SIGMAR1 (0.42) SIGMAR1
SCHEMBL1924724 0.70 DRD2 (0.38) HTR2CCA2

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 2145 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063326-A Method for promoting nickel catalysis to synthesize arylamine compound by red light 陕西师范大学 2024-05-24 CN claimed
EP-4357351-A1 TRAP1 INHIBITOR AND USE THEREOF Smartin Bio Inc. (KR) 2024-04-24 EP claimed
US-20240122941-A1 THERAPY BASED ON SYNTHETIC LETHALITY IN SWI/SNF COMPLEX-DYSFUNCTION CANCER NATIONAL CANCER CENTER (JP) 2024-04-18 US claimed
CN-117836296-A Pyrazolopyridone compounds 百济神州有限公司 2024-04-05 CN claimed
CN-117769559-A TRAP1 inhibitors and uses thereof 斯玛特恩生物公司 2024-03-26 CN claimed
WO-2023148206-A1 MICROBIOCIDAL N-AMIDE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-08-10 WO claimed
US-11572384-B2 Unusual substrates of tubulin tyrosine ligase FORSCHUNGSVERBUND BERLIN E.V. (DE) 2023-02-07 US claimed
US-11535647-B2 Peptide purification method using sulfonate compound NAGASE & CO., LTD. (JP) 2022-12-27 US claimed
WO-2022265178-A1 TRAP1 INHIBITOR AND USE THEREOF 주식회사 스마틴바이오 2022-12-22 WO claimed
CN-109923116-B [1,2,4] triazolo [1,5-a ] pyrimidine derivatives as PDE2 inhibitors 詹森药业有限公司 2022-12-06 CN claimed
US-5478857-A Administering inhibitor of phospholipase A2 ELI LILLY AND COMPANY (US) 1995-12-26 US claimed
EP-0685466-A1 3-Heteroaliphatyle-and 3-hetero-(aryle)-aliphatyle-2(1H)-quinolone derivatives CIBA-GEIGY AG (CH) 1995-12-06 EP claimed
WO-1995017183-A1 USE OF PLA2 INHIBITORS AS TREATMENT FOR ALZHEIMER'S DISEASE ELI LILLY AND COMPANY (US) 1995-06-29 WO claimed
EP-0406438-B1 PRODUCTION OF GLYCIDYL ETHER KOWA CO (JP) 1994-03-16 EP claimed
US-4997836-A Inhibitor of platelet activating factor TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-03-05 US claimed
US-4939128-A Antiischemic agents; circulatory disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1990-07-03 US claimed
EP-0100200-B1 2-SUBSTITUTED 4-AMINO-6,7-DIMETHOXYQUINOLINES Pfizer Limited (GB) 1987-05-06 EP claimed
US-4656174-A HYPOTENSIVE AGENTS PFIZER INC. (US) 1987-04-07 US claimed
EP-0202589-A2 Pharmaceutical compositions containing ascorbic acid derivatives Takeda Chemical Industries, Ltd. (JP) 1986-11-26 EP claimed
EP-0100200-A1 2-Substituted 4-amino-6,7-dimethoxyquinolines Pfizer Limited (GB) 1984-02-08 EP claimed