SCHEMBL10909573

SCHEMBL10909573

CCN(c1cccc(C)c1)C(C)O.[NaH]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
THRB P10828 1/20 0.39
PKM P14618 1/20 0.39
POLQ O75417 2/20 0.38
HTT P42858 2/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 4/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
PAX8 Q06710 2/20 0.38
GPX4 P36969 1/20 0.38
CETP P11597 1/20 0.37
GLA P06280 1/20 0.37

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
SCHEMBL1802310 0.98 TP53 (0.45) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL9446178 0.85 ALDH1A1 (0.43) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL17101217 0.84 MAPT (0.41) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL11321199 0.83 TP53 (0.44) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL11785353 0.82 TP53 (0.47) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL8394324 0.81 TP53 (0.45) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL2405543 0.81 TP53 (0.45) TP53MAPTHPGDTDP1THRB
SCHEMBL9001023 0.81 TP53 (0.45) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL11748273 0.80 TP53 (0.42) TP53MAPTHPGDTDP1SLC6A2
SCHEMBL11786816 0.80 GPX4 (0.54) TP53MAPTSLC6A2SLC6A4ALDH1A1

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-4605615-A CULTURING STREPTOMYCES TOYO JOZO KABUSHIKI KAISHA (JP) 1986-08-12 US disclosed