SCHEMBL1744458

SCHEMBL1744458

CC(C)CCC(=O)ONP(=O)(Cl)Oc1cccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 3/20 0.41
OGG1 O15527 1/20 0.39
KCNJ11 Q14654 1/20 0.39
CYP2D6 P10635 1/20 0.39
ALDH1A1 P00352 3/20 0.39
PGR P06401 1/20 0.39
GAA P10253 1/20 0.39
PTGS1 P23219 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 2/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 2/20 0.37

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
SCHEMBL7265474 0.77 ALDH1A1 (0.54) OGG1ALDH1A1PGRGAAPTGS1
SCHEMBL14941788 0.76 ALDH1A1 (0.39) BTN3A1OGG1ALDH1A1PGRGAA
SCHEMBL14941789 0.76 ALDH1A1 (0.39) BTN3A1OGG1ALDH1A1PGRGAA
SCHEMBL720803 0.74 BTN3A1 (0.41) BTN3A1OGG1CYP2D6ALDH1A1PGR
SCHEMBL724231 0.74 BCL2L1 (0.48) OGG1ALDH1A1KDM4EHPGDKMT2A
SCHEMBL720804 0.74 BTN3A1 (0.41) BTN3A1OGG1CYP2D6ALDH1A1PGR
SCHEMBL719597 0.73 ALDH1A1 (0.43) BTN3A1OGG1ALDH1A1PGRGAA
SCHEMBL21097713 0.73 BTN3A1 (0.58) BTN3A1OGG1ALDH1A1PGRGAA
SCHEMBL1273621 0.73 ALDH1A1 (0.43) BTN3A1OGG1ALDH1A1PGRGAA
SCHEMBL12091742 0.73 ALDH1A1 (0.43) BTN3A1OGG1ALDH1A1PGRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2385951-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS University College Cardiff Consultants, Ltd. (GB) 2011-11-16 EP disclosed
US-20110254856-A1 MOBILE TERMINAL AND METHOD OF CONTROLLING OPERATION OF THE MOBILE TERMINAL LG ELECTRONICS INC. (KR) 2011-10-20 US disclosed
WO-2010081082-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS UNIVERSITY COLLEGE OF CARDIFF CONSULTANTS LIMITED (GB) 2010-07-15 WO disclosed