SCHEMBL8780315

SCHEMBL8780315

CCC1CCC(N)(N)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
GAA P10253 2/20 0.47
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
POLB P06746 1/20 0.37
NOS3 P29474 2/20 0.32
NOS1 P29475 2/20 0.32
NOS2 P35228 2/20 0.32
MAPT P10636 1/20 0.31
ALOX12 P18054 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
SCHEMBL25568569 0.81 ALDH1A1 (0.44) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL19525730 0.81 ALDH1A1 (0.44) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL25568576 0.81 ALDH1A1 (0.44) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL9405284 0.79 CYP1A2 (0.36) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL539166 0.77
SCHEMBL19501864 0.77 KDM4E (0.45) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL15142347 0.76 KDM4E (0.67) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL28053277 0.75 CYP1A2 (0.54) HPGDPOLBNOS3NOS1NOS2
SCHEMBL25619381 0.75 KDM4E (0.37) KDM4EALDH1A1GAAHPGDSMN1; SMN2
SCHEMBL20103945 0.74 KDM4E (0.43) KDM4EALDH1A1GAAHPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108516939-A A kind of preparation method of high anti-body 4,4 '-diamino-dicyclohexyl methane of content 万华化学集团股份有限公司 2018-09-11 CN claimed
CN-102953065-B Corrosion inhibition neutralizer for metal corrosion prevention and preparation method thereof PETROCHINA COMPANY LIMITED (CN) 2014-10-15 CN claimed
EP-3891233-A1 DISPERSANT AND WATERBORNE EPOXY COATING COMPOSITION Dow Global Technologies LLC (US) 2021-10-13 EP disclosed
EP-3737715-A1 FORMALDEHYDE FREE ADHESIVE COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2020-11-18 EP disclosed
WO-2020113366-A1 DISPERSANT AND WATERBORNE EPOXY COATING COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2020-06-11 WO disclosed
EP-3630900-A1 WATERBORNE EPOXY COATING COMPOSITION Dow Global Technologies LLC (US) 2020-04-08 EP disclosed
WO-2018218631-A1 WATERBORNE EPOXY COATING COMPOSITION DOW GLOBAL TECHNOLOGIES LLC (US) 2018-12-06 WO disclosed
CN-108699270-A POLYIMIDE FILM, METHOD FOR PRODUCING POLYIMIDE FILM, AND POLYIMIDE PRECURSOR RESIN COMPOSITION 大日本印刷株式会社 2018-10-23 CN disclosed
CN-102953065-B Corrosion inhibition neutralizer for metal corrosion prevention and preparation method thereof PETROCHINA COMPANY LIMITED (CN) 2014-10-15 CN disclosed
CN-102653623-A Epoxy resin imbibed polymer particles ROHM & HAAS 2012-09-05 CN disclosed
EP-0601668-B1 Epoxy resin composition SHELL INT RESEARCH (NL) 1997-03-19 EP disclosed
EP-0601668-A2 Epoxy resin composition SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1994-06-15 EP disclosed