SCHEMBL8799546

SCHEMBL8799546

Cc1cccc(N)c1C(=O)Nc1cccc2c(C(C)(C)O)c(C)oc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 5/20 0.38
HTT P42858 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
MAOB P27338 2/20 0.37
PDK1 Q15118 1/20 0.36
PDK2 Q15119 1/20 0.36
PDK3 Q15120 1/20 0.36
PDK4 Q16654 1/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 3/20 0.36
GPR35 Q9HC97 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL7817437 0.87 ALDH1A1 (0.39) ALDH1A1LMNAMAPTNPSR1KDM4E
SCHEMBL7827083 0.87 TYK2 (0.47) ALDH1A1LMNAMAPTNPSR1KDM4E
SCHEMBL7815641 0.83 TDP1 (0.43) ALDH1A1LMNAMAPTNPSR1HTT
SCHEMBL7824213 0.83 RAB9A (0.41) ALDH1A1LMNAMAPTNPSR1HTT
SCHEMBL7816325 0.82 MAOB (0.38) ALDH1A1LMNAMAPTNPSR1KDM4E
SCHEMBL7827508 0.80 GPR35 (0.50) ALDH1A1MAPTKDM4EHTTPDK1
SCHEMBL8799382 0.79 TYK2 (0.37) ALDH1A1LMNAMAPTNPSR1RAB9A
SCHEMBL7816537 0.78 GPR35 (0.41) ALDH1A1LMNAMAPTNPSR1PDK1
SCHEMBL8799550 0.78 ALDH1A1 (0.38) ALDH1A1LMNAMAPTNPSR1KDM4E
SCHEMBL7825378 0.77 GAA (0.42) ALDH1A1LMNAMAPTNPSR1MAPK1

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
EP-0757682-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-02-12 EP disclosed
WO-1995029907-A1 BENZOFURAN DERIVATIVES USEFUL AS INHIBITORS OF BONE RESORPTION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-11-09 WO disclosed