SCHEMBL10693391

SCHEMBL10693391

CC1C(=O)N(C)Oc2cc(C(=O)c3ccc(Cl)cc3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
HTT P42858 4/20 0.39
HRH3 Q9Y5N1 1/20 0.39
SRD5A2 P31213 1/20 0.37
MAPT P10636 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HPGD P15428 1/20 0.37
HCRTR2 O43614 2/20 0.36
ELANE P08246 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ADORA1 P30542 1/20 0.36
LMNA P02545 2/20 0.35
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL10693989 0.83 MAOB (0.52) RELA
SCHEMBL10692526 0.78 MGLL (0.37) MAPK1HTTHRH3CYP1A2CYP2D6
SCHEMBL10693566 0.75 SRD5A2 (0.41) MAPK1HTTSRD5A2MAPTCYP1A2
SCHEMBL10693701 0.75 SRD5A2 (0.38) MAPK1HTTHRH3SRD5A2MAPT
SCHEMBL10691134 0.73 MAPK1 (0.41) MAPK1HTTHRH3SRD5A2MAPT
SCHEMBL10693327 0.72 XDH (0.49) MAPTMEN1KMT2ALMNANPC1
SCHEMBL7678489 0.65 HTT (0.46) MAPK1HTTHRH3MAPTCYP1A2
SCHEMBL809735 0.65 ATM (0.67) MAPK1SRD5A2L3MBTL1HPGDCNR1
SCHEMBL9065412 0.64 SRD5A2 (0.80) MAPK1HTTSRD5A2MAPTL3MBTL1
SCHEMBL10697158 0.64 SRD5A2 (0.80) MAPK1HTTSRD5A2MAPTL3MBTL1

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-4778792-A Use of 7-acyl benzoxazinones and their derivatives in treating atheromatous disorders LABORATORIES NEGMA (FR) 1988-10-18 US disclosed