SCHEMBL9733388

SCHEMBL9733388

CC1(C)Oc2ccc(Br)cc2C(n2ccccc2=O)=C1C=O

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
APP P05067 1/20 0.31
PTGES O14684 1/20 0.30
CYP19A1 P11511 1/20 0.30

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
SCHEMBL9733351 0.87 RXFP1 (0.31)
SCHEMBL9734444 0.84 ALDH1A1 (0.36) MEN1MAPTKMT2A
SCHEMBL9733395 0.84 S100A4 (0.35) RAB9A
SCHEMBL9368399 0.84 ABCC9 (0.34)
SCHEMBL9737114 0.83 F10 (0.38)
SCHEMBL9732430 0.82 F10 (0.32)
SCHEMBL9146624 0.82 NR1H4 (0.32) NR1H4NPSR1MAPTPTGESCYP19A1
SCHEMBL9732982 0.81 ALOX5 (0.38) MEN1MAPTRAB9AKMT2A
SCHEMBL9147909 0.81 NR1H4 (0.33) NR1H4NPSR1MAPT
SCHEMBL9146948 0.78 NR1H4 (0.34) NR1H4NPSR1MAPT

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-5143924-A OXODIHYDROPYRIDYL CHROMAN DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-09-01 US disclosed