SCHEMBL9029626

SCHEMBL9029626

CCCCCCNNC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.50
HDAC1 Q13547 5/20 0.49
HDAC3 O15379 4/20 0.49
HDAC2 Q92769 4/20 0.49
HDAC11 Q96DB2 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 1/20 0.46
CASP2 P42575 1/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.42
ZDHHC2 Q9UIJ5 1/20 0.42
NAAA Q02083 1/20 0.42
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
SPHK1 Q9NYA1 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
SCHEMBL29047889 1.00 EPHX1 (0.50) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL8741361 1.00 EPHX1 (0.50) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL28891444 1.00 EPHX1 (0.50) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL8587015 1.00 EPHX1 (0.50) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL28059419 1.00 EPHX1 (0.50) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL11032495 1.00 EPHX1 (0.50) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL253169 0.98 HDAC1 (0.47) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL11293176 0.91
SCHEMBL31486286 0.90 EPHX1 (0.50) EPHX1HDAC1HDAC3HDAC2HDAC11
SCHEMBL2183139 0.89 FAAH (0.58)

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0720621-A1 RADIOLABELED SOMATOSTATIN-DERIVED PEPTIDES FOR IMAGING AND THERAPEUTIC USES Diatide, Inc. (US) 1996-07-10 EP claimed
CN-113929866-B Modified resin and resin composition 旭化成株式会社 2023-07-07 CN disclosed
CN-111205424-B Modified resin and resin composition 旭化成株式会社 2022-04-08 CN disclosed
CN-113929866-A Modified resin and resin composition 旭化成株式会社 2022-01-14 CN disclosed
CN-107629183-B Modified resin and resin composition 旭化成株式会社 2021-01-05 CN disclosed
CN-111205424-A Modified resin and resin composition 旭化成株式会社 2020-05-29 CN disclosed
CN-105358602-B modified resin and resin composition 旭化成株式会社 2018-12-04 CN disclosed
CN-107629183-A Modified resin and resin combination 旭化成株式会社 2018-01-26 CN disclosed
CN-103459527-B Solvent-borne clearcoat coating composition, method for producing it and use thereof 巴斯夫涂料有限公司 2017-05-24 CN disclosed
CN-105358602-A Modified resin and resin composition ASAHI KASEI CHEMICALS CORP 2016-02-24 CN disclosed