SCHEMBL27645883

SCHEMBL27645883

O=COc1cccc(-c2ccccc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
RAB9A P51151 3/20 0.54
ASIC3 Q9UHC3 1/20 0.46
SLC6A2 P23975 1/20 0.44
SLC6A4 P31645 1/20 0.44
KCNH2 Q12809 1/20 0.44
ALDH1A1 P00352 5/20 0.38
MAPT P10636 3/20 0.38
ADORA3 P0DMS8 1/20 0.35
HPGD P15428 2/20 0.35
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ADORA2A P29274 2/20 0.35
TSHR P16473 1/20 0.35
ATM Q13315 1/20 0.35
AURKA O14965 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PRKACA P17612 1/20 0.35
SMN1; SMN2 Q16637 2/20 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
SCHEMBL5103779 0.78 MEN1 (0.65) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL11209392 0.75 MEN1 (0.46) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL28043667 0.75 BTK (0.41) ALDH1A1MAPTHPGDPOLBHSD17B10
SCHEMBL1360819 0.75 RAB9A (0.60) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL18335708 0.73 RAB9A (0.58) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL58442 0.72 MEN1 (1.00) MEN1KMT2ARAB9AASIC3ALDH1A1
SCHEMBL13996079 0.72 RAB9A (0.56) MEN1KMT2ARAB9AASIC3SLC6A2
SCHEMBL1762113 0.71 CCR1 (0.43) MEN1KMT2ARAB9AALDH1A1HPGD
SCHEMBL27925936 0.71 CYP3A4 (0.42) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL1359228 0.71 MEN1 (0.60) MEN1KMT2ARAB9AASIC3ALDH1A1

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
CN-1875026-A Platinum complex and luminescent element TAKASAGO PERFUMERY CO LTD (JP) 2006-12-06 CN disclosed