SCHEMBL1713044

SCHEMBL1713044

C#COC(=O)c1ccc(C(=O)Oc2ccccc2)o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.46
ALDH1A1 P00352 3/20 0.43
HSD17B10 Q99714 2/20 0.43
TSHR P16473 2/20 0.43
F2 P00734 2/20 0.43
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
GLA P06280 1/20 0.41
MAPT P10636 5/20 0.40
KDM4E B2RXH2 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
NSD2 O96028 1/20 0.40
RAB9A P51151 1/20 0.39
PRSS1 P07477 2/20 0.39
TMPRSS15 P98073 2/20 0.39
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP1A2 P05177 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL70871 0.86 HSD17B10 (0.53) KMT2AALDH1A1HSD17B10TSHRF2
SCHEMBL1712826 0.86 HDAC4 (0.41) KMT2AALDH1A1TSHRF2HPGD
SCHEMBL18913216 0.80 KMT2A (0.49) KMT2AALDH1A1HSD17B10TSHRF2
SCHEMBL4528196 0.79 HSD17B10 (0.58) KMT2AALDH1A1HSD17B10TSHRHPGD
SCHEMBL21638941 0.79 PARP10 (0.54) KMT2AALDH1A1HSD17B10HPGDALOX15
SCHEMBL1713103 0.77 KMT2A (0.57) KMT2AALDH1A1HSD17B10HPGDMAPT
SCHEMBL20183135 0.75 MAPT (0.51) KMT2AALDH1A1MAPTKDM4ETDP1
SCHEMBL669741 0.74 TDP1 (0.42) KMT2AALDH1A1HSD17B10HPGDALOX15
SCHEMBL27727679 0.74 KMT2A (0.50) KMT2AALDH1A1HSD17B10TSHRF2
SCHEMBL6829604 0.71 PRSS1 (0.48) KMT2AALDH1A1HSD17B10TSHRF2

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-2344568-B1 ACETYLENIC POLYAMIDE NEXAM CHEMICAL AB (SE) 2017-12-20 EP claimed
US-8492507-B2 Acetylenic polyamide NEXAM CHEMICAL AB (SE) 2013-07-23 US claimed
US-20110190469-A1 ACETYLENIC POLYAMIDE NEXAM CHEMICAL AB (SE) 2011-08-04 US claimed
EP-2344568-A1 ACETYLENIC POLYAMIDE Nexam Chemical AB (SE) 2011-07-20 EP claimed
WO-2010036170-A1 ACETYLENIC POLYAMIDE NEXAM CHEMICAL AB (SE) 2010-04-01 WO claimed
EP-2344568-B1 ACETYLENIC POLYAMIDE NEXAM CHEMICAL AB (SE) 2017-12-20 EP disclosed
US-8492507-B2 Acetylenic polyamide NEXAM CHEMICAL AB (SE) 2013-07-23 US disclosed
US-20110190469-A1 ACETYLENIC POLYAMIDE NEXAM CHEMICAL AB (SE) 2011-08-04 US disclosed
EP-2344568-A1 ACETYLENIC POLYAMIDE Nexam Chemical AB (SE) 2011-07-20 EP disclosed
WO-2010036170-A1 ACETYLENIC POLYAMIDE NEXAM CHEMICAL AB (SE) 2010-04-01 WO disclosed