SCHEMBL7698680

SCHEMBL7698680

O=C(CCc1ccccc1)Nc1ccc(-c2oc(-c3ccccc3)nc2C(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
HTT P42858 1/20 0.53
LMNA P02545 1/20 0.51
TOP2A P11388 1/20 0.51
TOP2B Q02880 1/20 0.51
ROCK2 O75116 1/20 0.51
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51
MMP13 P45452 1/20 0.51
KDM4E B2RXH2 2/20 0.48
TSHR P16473 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HPGD P15428 1/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 1/20 0.48
RGS12 O14924 1/20 0.48
ALDH1A1 P00352 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
SCHEMBL7701405 0.87 NPC1 (0.56) MAPTHTTKDM4ETSHRHPGD
SCHEMBL7700048 0.87 NPC1 (0.50) MAPTHTTKDM4EMEN1KMT2A
SCHEMBL7697078 0.85 HPGD (0.56) MAPTLMNAKDM4ETSHRMEN1
SCHEMBL7701371 0.85 GAA (0.48) MAPTHTTLMNATOP2ATOP2B
SCHEMBL7703221 0.85 RAB9A (0.67) MAPTKDM4EMEN1KMT2AHPGD
SCHEMBL7701952 0.83 MAPT (0.54) MAPTHTTLMNAKDM4EKMT2A
SCHEMBL7698887 0.82 ALDH1A1 (0.49) MAPTHTTMEN1KMT2AHPGD
SCHEMBL7694301 0.82 RAB9A (0.52) MAPTHTTKDM4EMEN1KMT2A
SCHEMBL7698683 0.82 MAPT (0.52) MAPTHTTKDM4EMEN1KMT2A
SCHEMBL7701153 0.82 ALDH1A1 (0.63) MAPTHTTLMNAKDM4ETSHR

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
WO-2002064558-A2 OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS SANKYO COMPANY, LIMITED (JP) 2002-08-22 WO disclosed