SCHEMBL11904090

SCHEMBL11904090

NC(=O)c1cccc(OC(=O)C2CCCCC2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.48
POLB P06746 2/20 0.48
ESR1 P03372 1/20 0.46
ESR2 Q92731 1/20 0.46
KMT2A Q03164 8/20 0.44
USP2 O75604 1/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ELANE P08246 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
KCNH2 Q12809 1/20 0.42
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
ALDH1A1 P00352 3/20 0.40
GLA P06280 2/20 0.40
ADORA1 P30542 1/20 0.40
RAB9A P51151 1/20 0.40
CA2 P00918 1/20 0.39
GAA P10253 2/20 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
SCHEMBL27830114 0.79 POLB (0.47) POLBESR1ESR2KMT2AUSP2
SCHEMBL6662281 0.76 PIM1 (0.46) TDP1KCNH2ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL27814695 0.75 KMT2A (0.49) POLBESR1ESR2KMT2AUSP2
SCHEMBL27753293 0.72 NNMT (0.53) PKMPOLBKMT2AHTTSMN1; SMN2
SCHEMBL20815627 0.72 L3MBTL1 (0.47) POLBESR1ESR2KMT2AHTT
SCHEMBL29447025 0.71 NNMT (0.56) POLBKMT2ATDP1KCNH2MEN1
SCHEMBL2304053 0.71 NNMT (0.56) POLBKMT2ATDP1KCNH2MEN1
SCHEMBL21410586 0.70 KMT2A (0.46) PKMPOLBESR1ESR2KMT2A
SCHEMBL24500157 0.69 KMT2A (0.68) POLBKMT2AUSP2HTTSMN1; SMN2
SCHEMBL2406824 0.69 ESR1 (0.61) POLBESR1ESR2KMT2AUSP2

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
CN-101370773-B Cycloalkanecarboxamide derivative and method for producing same SEIKAGAKU KOGYO CO LTD 2014-04-09 CN disclosed
EP-1975162-B1 OXAZOLONE DERIVATIVE SEIKAGAKU KOGYO CO LTD (JP) 2012-08-15 EP disclosed
CN-101370773-A Cycloalkanecarboxamide derivative and method for producing same SEIKAGAKU KOGYO CO LTD (JP) 2009-02-18 CN disclosed