SCHEMBL49819

SCHEMBL49819

C1CCC([N]C2CCCC2)C1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.44
HIF1A Q16665 1/20 0.44
ALDH1A1 P00352 2/20 0.40
THRB P10828 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL7647781 0.96 EPHX1 (0.50) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL49195 0.96 EPHX1 (0.50) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL819653 0.96 EPHX1 (0.50) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL1678970 0.96
SCHEMBL49353 0.96 EPHX1 (0.50) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL7644168 0.96 EPHX1 (0.50) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL2917831 0.96 EPHX1 (0.50) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL1678725 0.92 EPHX1 (0.47) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL1679055 0.92 EPHX1 (0.47) EPHX1HIF1AALDH1A1KMT2ASIGMAR1
SCHEMBL1679057 0.92 EPHX1 (0.47) EPHX1HIF1AALDH1A1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023245156-A2 VESICULAR MONOAMINE TRANSPORTER-2 LIGANDS AND THEIR USE IN THE TREATMENT OF PSYCHOSTIMULANT ABUSE UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2023-12-21 WO claimed
US-10923342-B2 Selective modification method of a base material surface JSR CORPORATION (JP) 2021-02-16 US claimed
US-4550162-A Process for the manufacture of enol derivatives CIBA-GEIGY CORPORATION (US) 1985-10-29 US claimed
US-4434287-A Cephalosporin derivatives CIBA-GEIGY CORPORATION (US) 1984-02-28 US claimed
US-4319027-A Process for the manufacture of ceohem enol derivatives CIBA-GEIGY CORPORATION (US) 1982-03-09 US claimed
US-4293462-A Process for the manufacture of enol derivatives, and intermediates CIBA-GEIGY CORPORATION (US) 1981-10-06 US claimed
US-4110533-A PROCESS FOR THE MANUFACTURE OF ENOL DERIVATIVES CIBA-GEIGY CORPORATION (US) 1978-08-29 US claimed
WO-2024128000-A1 ISOPOLYOXOTUNGSTATE SALT COMPOUND, SOLVATE THEREOF OR MIXTURE OF SAID COMPOUND AND SOLVATE, AND METHOD FOR PRODUCING SAID COMPOUND, SOLVATE OR MIXTURE 東京応化工業株式会社 2024-06-20 WO disclosed
WO-2024098339-A1 POLYMER, PEROVSKITE SOLAR CELL, PHOTOVOLTAIC MODULE, AND ELECTRICAL DEVICE 宁德时代新能源科技股份有限公司 2024-05-16 WO disclosed
EP-4365180-A1 RARE EARTH COMPLEX Tosoh Corporation (JP) 2024-05-08 EP disclosed
EP-3395583-B1 HEAT-SENSITIVE RECORDING MATERIAL NIPPON KAYAKU KK (JP) 2024-03-27 EP disclosed
WO-2024043261-A1 AZO COMPOUND OR SALT THEREOF, AND POLARIZING FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY DEVICE COMPRISING SAME 日本化薬株式会社 2024-02-29 WO disclosed
CN-117616032-A Rare earth complex 东曹株式会社 2024-02-27 CN disclosed
EP-0055217-A2 Process for the preparation of derivatives of 7-beta-substituted 3-cephem-4-carboxylic acids not substituted in position 3 CIBA-GEIGY AG (CH) 1982-06-30 EP disclosed
US-4319027-A Process for the manufacture of ceohem enol derivatives CIBA-GEIGY CORPORATION (US) 1982-03-09 US disclosed
US-4313945-A 7-Thiazolyl-acetamido-cephem derivatives with terminal aminocarboxylic acid grouping CIBA-GEIGY CORPORATION (US) 1982-02-02 US disclosed
US-4293462-A Process for the manufacture of enol derivatives, and intermediates CIBA-GEIGY CORPORATION (US) 1981-10-06 US disclosed
EP-0016296-A1 Cephalosporin derivatives, process for their preparation, compositions containing them, and intermediates and their preparation CIBA-GEIGY AG (CH) 1980-10-01 EP disclosed
US-4110533-A PROCESS FOR THE MANUFACTURE OF ENOL DERIVATIVES CIBA-GEIGY CORPORATION (US) 1978-08-29 US disclosed
US-3960886-A Substituted N-arylanilines STERLING DRUG INC. (US) 1976-06-01 US disclosed