SCHEMBL2204

SCHEMBL2204

[O]CCCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.58
MAOB P27338 2/20 0.56
MAPT P10636 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
ALDH1A1 P00352 1/20 0.55
HPGD P15428 1/20 0.55
ALOX15 P16050 1/20 0.55
ALOX12 P18054 1/20 0.55
CASP1 P29466 1/20 0.55
HSD17B10 Q99714 1/20 0.55
SIGMAR1 Q99720 8/20 0.54
HDAC3 O15379 1/20 0.54
MAPK1 P28482 1/20 0.54
ADRA1A P35348 1/20 0.54
HDAC4 P56524 1/20 0.54
SLC6A3 Q01959 1/20 0.54
HDAC1 Q13547 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54

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
SCHEMBL1006398 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL1006411 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL95367 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL94958 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL999810 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL1006478 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL1006936 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL1006131 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL1006371 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1
SCHEMBL1007093 0.97 MAPT (0.59) MAOAMAOBMAPTRXFP1ALDH1A1

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 2170 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118251379-A Iron death inhibitor and use thereof 学校法人自治医科大学 2024-06-25 CN claimed
WO-2023085420-A1 FERROPTOSIS INHIBITOR AND USE THEREFOR 学校法人自治医科大学 2023-05-19 WO claimed
CN-111233786-B Benzene sulfonamide compound containing five-membered heterocycle and preparation method and application thereof 中国人民解放军军事科学院军事医学研究院 2021-11-26 CN claimed
CN-107963982-B Polyisocyanate composition and isocyanate polymer composition 旭化成株式会社 2021-11-12 CN claimed
CN-112898286-A Benzothiophene compound or pharmaceutically acceptable salt and isomer thereof, and preparation method, pharmaceutical composition and application thereof 中国药科大学 2021-06-04 CN claimed
CN-111233786-A Benzene sulfonamide compound containing five-membered heterocycle and preparation method and application thereof 中国人民解放军军事科学院军事医学研究院 2020-06-05 CN claimed
EP-2612656-B1 PROCESS FOR PRODUCING DRUG BLOCK-COPOLYMER COMPOSITE AND PHARMACEUTICAL PRODUCT CONTAINING SAME NIPPON KAYAKU KK (JP) 2020-02-26 EP claimed
EP-2491951-B1 BLOCK COPOLYMER FOR INTRAPERITONEAL ADMINISTRATION CONTAINING ANTI-CANCER AGENT, MICELLE PREPARATION, AND CANCER THERAPEUTIC AGENT COMPRISING THE MICELLE PREPARATION AS ACTIVE INGREDIENT NIPPON KAYAKU KK (JP) 2017-09-20 EP claimed
EP-2268273-B1 SMALL-MOLECULE MODULATORS OF TRP-P8 ACTIVITY DENDREON PHARMACEUTICALS INC (US) 2017-06-28 EP claimed
CN-106588633-A Crystal of fumarate of salmeterol intermediate and preparation process thereof 江苏恒盛药业有限公司 2017-04-26 CN claimed
WO-1995030655-A1 TRYPTAMINE DERIVATIVES AS 5-HT-1D RECEPTOR LIGANDS ALLELIX BIOPHARMACEUTICALS INC. (CA) 1995-11-16 WO claimed
WO-1995018131-A1 NEW GINKGOLIDE DERIVATIVES AND A PROCESS FOR PREPARING THEM SUNKYONG INDUSTRIES CO., LTD. (KR) 1995-07-06 WO claimed
EP-0589018-A1 AMINES AS INHIBITORS OF SQUALENE SYNTHASE ZENECA LIMITED (GB) 1994-03-30 EP claimed
WO-1993020807-A1 AMINES AS INHIBITORS OF SQUALENE SYNTHASE ZENECA LIMITED (GB) 1993-10-28 WO claimed
EP-0268242-B1 PAF-ANTAGONISTIC THIENOTRIAZOLODIAZEPINE COMPOUNDS AND PHARMACEUTICAL USES THEREOF Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1992-03-18 EP claimed
US-4744819-A 4-oxo pyridinecarboxamide derivatives as plant growth regulators DAICEL CHEMICAL INDUSTRIES LTD. (JP) 1988-05-17 US claimed
US-4725306-A Pyridinecarboxamide plant growth inhibitors DAICEL CHEMICAL INDUSTRIES LTD. (JP) 1988-02-16 US claimed
US-4647579-A Circulation active novel substituted 4-hydroxy-benzopyrans BAYER AKTIENGESELLSCHAFT (DE) 1987-03-03 US claimed
US-4066438-A HERBICIDES THE DOW CHEMICAL COMPANY (US) 1978-01-03 US claimed
US-4021421-A ENZYME INDUCING ACTIVITY RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1977-05-03 US claimed