SCHEMBL9564682

SCHEMBL9564682

CCC(C)(C(=O)c1cc(C)cs1)N1CCOCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.40
DAO P14920 1/20 0.40
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 2/20 0.36
THRB P10828 1/20 0.36
RECQL P46063 1/20 0.36
MAPK1 P28482 2/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HRH3 Q9Y5N1 1/20 0.35
CNR2 P34972 5/20 0.34
MMP12 P39900 3/20 0.34
MAPT P10636 1/20 0.34
MMP2 P08253 1/20 0.34
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GRIN2B Q13224 1/20 0.34

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
SCHEMBL10383861 0.91 HPGD (0.39) HPGDDAOALDH1A1MEN1KMT2A
SCHEMBL5367666 0.89 DAO (0.39) HPGDDAOALDH1A1MEN1KMT2A
SCHEMBL57063 0.85 ALDH1A1 (0.46) HPGDDAOALDH1A1MEN1KMT2A
Acetic Acid SCHEMBL31398487 0.82 DAO (0.45) HPGDDAOALDH1A1MEN1KMT2A
SCHEMBL10384869 0.80 DAO (0.35) HPGDDAOALDH1A1MEN1KMT2A
SCHEMBL3660464 0.79 DAO (0.39) DAOALDH1A1MEN1KMT2AKDM4E
SCHEMBL28278808 0.75 DAO (0.41) HPGDDAOALDH1A1MEN1KMT2A
SCHEMBL29051656 0.74 SMN1; SMN2 (0.44) HPGDDAOALDH1A1KDM4EMAPK1
SCHEMBL7559724 0.74 ALDH1A1 (0.43) HPGDALDH1A1MEN1KMT2AKDM4E
SCHEMBL10385894 0.72 DAO (0.49) HPGDDAOALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0536086-A1 Photosensitive mixtures CIBA-GEIGY AG (CH) 1993-04-07 EP claimed
EP-3045946-A1 PHOTOSENSITIVE RESIN COMPOSITION FOR OPTICAL WAVEGUIDE AND PHOTOCURABLE FILM FOR FORMATION OF OPTICAL WAVEGUIDE CORE LAYER, AS WELL AS OPTICAL WAVEGUIDE USING SAME AND MIXED-MOUNTING FLEXIBLE PRINTED WIRING BOARD FOR OPTICAL AND ELECTRICAL TRANSMISSION Nitto Denko Corporation (JP) 2016-07-20 EP disclosed
EP-2692773-A1 POLYETHER COMPOUND, CROSS-LINKING COMPOSITION, AND ELECTROLYTE Zeon Corporation (JP) 2014-02-05 EP disclosed
EP-0536086-A1 Photosensitive mixtures CIBA-GEIGY AG (CH) 1993-04-07 EP disclosed
US-5034307-A Photopolymerization of ethylenically unsaturated substrates CIBA-GEIGY CORPORATION (US) 1991-07-23 US disclosed
US-4970136-A PHOTOINITIATORS CIBA-GEIGY CORPORATION (US) 1990-11-13 US disclosed
US-4963470-A PHOTOINITIATORS CIBA-GEIGY CORPORATION (US) 1990-10-16 US disclosed
US-4960746-A A-HYDROXY-OR A-AMINO-ACETOPHENONES AND A TITANOCENE COMPOUND SUBSTITUTED BY FLUORINE CIBA-GEIGY CORPORATION (US) 1990-10-02 US disclosed
US-4857654-A Titanocenes and their use CIBA-GEIGY CORPORATION (US) 1989-08-15 US disclosed