SCHEMBL39698

SCHEMBL39698

C=CC(=O)c1ccc2c(=O)c3ccccc3sc2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
MAPT P10636 6/20 0.47
KDM4E B2RXH2 4/20 0.47
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
ALOX15 P16050 2/20 0.47
EGFR P00533 1/20 0.47
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
PKM P14618 1/20 0.47
ALOX12 P18054 1/20 0.47
JAK1 P23458 1/20 0.47
MAPK1 P28482 1/20 0.47
HSD17B10 Q99714 1/20 0.47
AKT1 P31749 1/20 0.43
RAB9A P51151 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42

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
SCHEMBL3796357 0.91 KDM4E (0.53) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL3556141 0.83 CYP1A2 (0.56) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL490172 0.81 TTR (0.54) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL11633242 0.80 KDM4E (0.49) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL9329684 0.80 KDM4E (0.53) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
Acrylic Acid SCHEMBL28027777 0.79 KDM4E (0.50) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL27654052 0.79 KDM4E (0.50) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL29012609 0.79 KDM4E (0.47) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL31120514 0.77 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EHPGDSMN1; SMN2
SCHEMBL3790672 0.77 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EHPGDSMN1; 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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10011688-B2 Hydrophilic gels derived from grafted photoinitiators COLOPLAST A/S (DK) 2018-07-03 US disclosed
US-10011688-B2 Hydrophilic gels derived from grafted photoinitiators COLOPLAST A/S (DK) 2018-07-03 US disclosed
US-9464143-B2 Grafted photoinitiators COLOPLAST A/S (DK) 2016-10-11 US disclosed
US-9464143-B2 Grafted photoinitiators COLOPLAST A/S (DK) 2016-10-11 US disclosed
US-20160168336-A1 HYDROPHILIC GELS DERIVED FROM GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2016-06-16 US disclosed
US-20160168336-A1 HYDROPHILIC GELS DERIVED FROM GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2016-06-16 US disclosed
US-9303129-B2 Hydrophilic gels derived from grafted photoinitiators COLOPLAST A/S (DK) 2016-04-05 US disclosed
US-9303129-B2 Hydrophilic gels derived from grafted photoinitiators COLOPLAST A/S (DK) 2016-04-05 US disclosed
CN-102947348-B Hydrophilic gels derived from grafted photoinitiators COLOPLAST AS 2014-12-24 CN disclosed
EP-2585492-A2 GRAFTED PHOTOINITIATORS Coloplast A/S (DK) 2013-05-01 EP disclosed
EP-2585496-A2 HYDROPHILIC GELS DERIVED FROM GRAFTED PHOTOINITIATORS Coloplast A/S (DK) 2013-05-01 EP disclosed
US-20130096220-A1 GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2013-04-18 US disclosed
US-20130096220-A1 GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2013-04-18 US disclosed
US-20130096221-A1 HYDROPHILIC GELS DERIVED FROM GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2013-04-18 US disclosed
US-20130096221-A1 HYDROPHILIC GELS DERIVED FROM GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2013-04-18 US disclosed
CN-102947348-A Hydrophilic gels derived from grafted photoinitiators COLOPLAST AS 2013-02-27 CN disclosed
WO-2011160636-A2 GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2011-12-29 WO disclosed
WO-2011160636-A2 GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2011-12-29 WO disclosed
WO-2011160640-A2 HYDROPHILIC GELS DERIVED FROM GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2011-12-29 WO disclosed
WO-2011160640-A2 HYDROPHILIC GELS DERIVED FROM GRAFTED PHOTOINITIATORS COLOPLAST A/S (DK) 2011-12-29 WO disclosed