SCHEMBL2262255

SCHEMBL2262255

C#COC(=O)CCCCCCCCC(=O)Oc1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MEN1 O00255 2/20 0.47
RAB9A P51151 1/20 0.47
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 2/20 0.44
PGR P06401 1/20 0.44
GAA P10253 1/20 0.44
PTGS1 P23219 1/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 2/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PIN1 Q13526 1/20 0.40
MMP2 P08253 1/20 0.39
POLM Q9NP87 1/20 0.39
POLK Q9UBT6 1/20 0.39
POLL Q9UGP5 1/20 0.39
POLH Q9Y253 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL2256429 1.00 KMT2A (0.47) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL2255538 0.99 KMT2A (0.48) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL11759471 0.89 ALDH1A1 (0.54) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL11018495 0.89 ALDH1A1 (0.54) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL25244833 0.87 ALDH1A1 (0.56) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL11018498 0.83 ALDH1A1 (0.54) KMT2AL3MBTL1MEN1RAB9AALDH1A1
SCHEMBL8015856 0.82 POLM (0.56) KMT2AL3MBTL1MEN1ALDH1A1HSD17B10
SCHEMBL32684946 0.82 POLM (0.56) KMT2AL3MBTL1MEN1ALDH1A1HSD17B10
SCHEMBL3740934 0.82 POLM (0.56) KMT2AL3MBTL1MEN1ALDH1A1HSD17B10
SCHEMBL32684916 0.82 POLM (0.56) KMT2AL3MBTL1MEN1ALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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