SCHEMBL2946

SCHEMBL2946

O=COc1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 2/20 0.47
HPGD P15428 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HSD17B10 Q99714 3/20 0.46
PGR P06401 1/20 0.46
GAA P10253 1/20 0.46
PTGS1 P23219 1/20 0.46
MAPK1 P28482 1/20 0.46
HTR1B P28222 7/20 0.46
KMT2A Q03164 2/20 0.44
RAB9A P51151 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MEN1 O00255 1/20 0.44
KCNA3 P22001 1/20 0.43
HTR1D P28221 2/20 0.42
OGG1 O15527 1/20 0.42
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL28814017 0.98 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL27786465 0.98 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL27808337 0.98 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDTDP1HSD17B10
Methylamine SCHEMBL27386148 0.94 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL1758084 0.88 HPRT1 (0.52) ALDH1A1KDM4EHPGDTDP1HSD17B10
Tert-Butylbenzene SCHEMBL27871935 0.85 ALDH1A1 (0.49) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28250584 0.84 ALDH1A1 (0.43) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL28232293 0.83 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL214710 0.82 ALDH1A1 (0.42) ALDH1A1KDM4EHPGDTDP1HSD17B10
SCHEMBL17291109 0.81 MAPT (0.38) ALDH1A1HPGDTDP1GAAKMT2A

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 12660 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12497636-B2 Recombinant Saccharomyces cerevisiae cells for cannabinoid production NATIONAL UNIVERSITY OF SINGAPORE (SG) 2025-12-16 US claimed
US-20250313518-A1 COLLOIDAL PHOSPHATE FERTILIZER WITH LIMITED RUN-OFF AND METHOD OF MAKING SAME THE ANDERSONS INC. (US) 2025-10-09 US claimed
US-12405533-B2 Resist underlayer film-forming composition containing substituted crosslinkable compound NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2025-09-02 US claimed
CN-119978403-A Coordination polymer based on pesticide ligand, preparation method and application thereof 北京农学院 2025-05-13 CN claimed
CN-119899022-A Corrosion-resistant silicon-aluminum refractory material for hazardous waste rotary kiln and preparation method 江苏朗耐德耐火材料有限公司 2025-04-29 CN claimed
CN-119678108-A Charging roller for electrophotographic apparatus 住友理工株式会社 2025-03-21 CN claimed
CN-115954444-B Preparation method of naphthalene polycarboxylate organic material and application of naphthalene polycarboxylate organic material in metal ion battery 中国科学院深圳先进技术研究院 2025-01-14 CN claimed
WO-2024087029-A1 PREPARATION METHOD FOR NAPHTHYL ORGANIC COMPOSITE ELECTRODE OF METAL ION BATTERY AND USE THEREOF 中国科学院深圳先进技术研究院 2024-05-02 WO claimed
CN-114207031-B Biodegradable resin and film prepared from same 东丽先端材料研究开发(中国)有限公司 2024-03-29 CN claimed
CN-117659764-A Coating dispersing agent with Wen Bianneng force resistance and preparation process thereof 宣城市聚源精细化工有限公司 2024-03-08 CN claimed
US-4180571-A Arylmalonamido-1-oxadethiacephalosporins SHIONOGI & CO., LTD. (JP) 1979-12-25 US claimed
EP-0002826-A1 Novel phosphoramidothioate derivatives, pesticidal compositions containing them, processes for preparing the novel derivatives and the use of the novel derivatives for combating pests ROHM AND HAAS COMPANY (US) 1979-07-11 EP claimed
US-4138570-A METHINE DYE BAYER AKTIENGESELLSCHAFT (DE) 1979-02-06 US claimed
US-4092474-A Cephalosporins having a metaloxy group in 3-substituent SHIONOGI & CO., LTD. (JA) 1978-05-30 US claimed
US-4091210-A Preparation of 3-alkyl-3-cephem-4-carboxylic acid compounds from dithio isopropenyl azetidine carboxylic compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1978-05-23 US claimed
US-4017557-A WIRE JACKETING, HOSE, BELTS, SEALS, GASKETS, LOW PRESSURE TIRES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-04-12 US claimed
US-4009159-A PENICILLINS FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1977-02-22 US claimed
US-3993646-A Process for the ring expansion of penicillins to cephalosporin compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JA) 1976-11-23 US claimed
US-3991042-A Basic azo dyestuffs containing a benzthiazole and a tetrahydroquinoline nucleus BAYER AKTIENGESELLSCHAFT (DT) 1976-11-09 US claimed
US-3948877-A POLYACRYLONITRILE, ACID MODIFIED POLYESTERS OR POLYAMIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 US claimed