SCHEMBL4423910

SCHEMBL4423910

CCCCCCCC(=O)c1ccc(Sc2ccc(C(=O)c3ccccc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.57
LMNA P02545 1/20 0.57
MAPT P10636 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
HSD17B3 P37058 7/20 0.56
HDAC8 Q9BY41 5/20 0.53
HDAC1 Q13547 4/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC2 Q92769 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
HDAC9 Q9UKV0 1/20 0.53
HDAC5 Q9UQL6 1/20 0.53
CES2 O00748 2/20 0.51
CES1 P23141 2/20 0.51
ALDH1A1 P00352 1/20 0.49
THRA P10827 1/20 0.48

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
SCHEMBL243463 0.93 HSD17B3 (0.61) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL10875468 0.93 HSD17B3 (0.61) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL10879508 0.93 HSD17B3 (0.61) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL10877102 0.93 HSD17B3 (0.61) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL10877296 0.93 HSD17B3 (0.61) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL10879487 0.93 HSD17B3 (0.61) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL10874949 0.91 HSD17B3 (0.60) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL19757451 0.91 L3MBTL1 (0.69) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL19757457 0.91 L3MBTL1 (0.69) L3MBTL1LMNAMAPTTDP1HSD17B3
SCHEMBL19757418 0.91 L3MBTL1 (0.69) L3MBTL1LMNAMAPTTDP1HSD17B3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1395615-B1 OXIME ESTER PHOTOINITIATORS HAVING A COMBINED STRUCTURE BASF SE (DE) 2009-10-21 EP disclosed
US-7189489-B2 Oxime ester photoiniators having a combined structure CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-03-13 US disclosed
US-20040170924-A1 Oxime ester photoiniators having a combined structure CIBA CORPORATION 2004-09-02 US disclosed
EP-1395615-A1 OXIME ESTER PHOTOINITIATORS HAVING A COMBINED STRUCTURE Ciba SC Holding AG (CH) 2004-03-10 EP disclosed
WO-2002100903-A1 OXIME ESTER PHOTOINITIATORS HAVING A COMBINED STRUCTURE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-12-19 WO disclosed