SCHEMBL13537152

SCHEMBL13537152

CCC(C)(C)Nc1ccc(C(=O)C(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.40
▸ DBH P09172 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ MLYCD O95822 1/20 0.37
▸ NAMPT P43490 1/20 0.36
▸ SLC2A1 P11166 2/20 0.36
▸ TRPA1 O75762 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ HTT P42858 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ AR P10275 1/20 0.35
▸ HPGD P15428 2/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TP53 P04637 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL25448327 0.86 KDM4E (0.44) KDM4EDBHGAARECQLMLYCD
SCHEMBL23456131 0.81 MAPT (0.46) GAAALDH1A1HTTSMN1; SMN2HPGD
SCHEMBL13537154 0.80 NR1H4 (0.44) KDM4EGAANAMPTALDH1A1HTT
SCHEMBL13866520 0.78 NAMPT (0.37) KDM4EMLYCDNAMPTALDH1A1AR
SCHEMBL18826796 0.78 MEN1 (0.54) KDM4EALDH1A1HTTSMN1; SMN2HPGD
SCHEMBL23683055 0.76 HPGDS (0.41) —
SCHEMBL10942931 0.74 MEN1 (0.50) KDM4EDBHGAARECQLMLYCD
SCHEMBL12948131 0.74 KDM4E (0.43) KDM4EDBHGAARECQLMLYCD
SCHEMBL14652437 0.74 KDM4E (0.47) KDM4EDBHGAARECQLMLYCD
SCHEMBL15342876 0.73 AR (0.41) KDM4EALDH1A1SMN1; SMN2ARHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7649025-B2 Composite ion-exchange membrane TOYO BOSEKI KABUSHIKI KAISHA (JP) 2010-01-19 — — US disclosed
Send feedback