SCHEMBL10696421

SCHEMBL10696421

CC1C(=O)Nc2ccc(Oc3ccccc3)cc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.50
MAOB P27338 3/20 0.50
PGR P06401 2/20 0.49
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP13 P45452 1/20 0.41
MAPT P10636 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GSTP1 P09211 1/20 0.40
AKR1B1 P15121 2/20 0.39
HPGD P15428 1/20 0.39
XDH P47989 1/20 0.39
TGM2 P21980 1/20 0.38
LTA4H P09960 1/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL11091196 0.81 MAOA (0.47) MAOAMAOBMMP2MMP3MMP9
SCHEMBL15730582 0.81 MAOA (0.51) MAOAMAOBPGR
SCHEMBL11514976 0.77 PGR (0.47) MAOAMAOBPGRMAPTTDP1
SCHEMBL9195493 0.75 PARP1 (0.59) MAOAMAOBMAPTTDP1L3MBTL1
SCHEMBL8202277 0.73 PGR (0.49) MAOAMAOBPGRMAPTL3MBTL1
SCHEMBL30088920 0.73 BRPF1 (0.53) PGRMAPTTDP1L3MBTL1
SCHEMBL260994 0.73 BRPF1 (0.53) PGRMAPTTDP1L3MBTL1
SCHEMBL19054962 0.73 BRPF1 (0.53) PGRMAPTTDP1L3MBTL1
SCHEMBL24112730 0.72 PGR (0.54) PGRHPGD
SCHEMBL9651557 0.72 PGR (0.54) PGRHPGD

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
EP-0255178-A2 Process for preparing hetero aryl and aryl alkanoic acids Nobel Chemicals AB (SE) 1988-02-03 EP disclosed