SCHEMBL25858364

SCHEMBL25858364

Brc1cccc2cccc(-c3ccc4sc5ccccc5c4c3)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
GPR3 P46089 1/20 0.40
ALDH1A1 P00352 4/20 0.35
MAPT P10636 3/20 0.35
HPGD P15428 3/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PTPN1 P18031 1/20 0.34
S1PR4 O95977 3/20 0.34
S1PR5 Q9H228 3/20 0.34
CTRC Q99895 1/20 0.34
CYP1A2 P05177 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
SLC9A1 P19634 1/20 0.33

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
SCHEMBL19395164 0.85 GPR3 (0.48) ALOX5GPR3ALDH1A1MAPTHPGD
SCHEMBL30513581 0.85 GPR3 (0.48) ALOX5GPR3ALDH1A1MAPTHPGD
SCHEMBL18820541 0.84 CA12 (0.40) ALOX5GPR3PTPN1S1PR4S1PR5
SCHEMBL17692104 0.84 ALOX5 (0.43) ALOX5GPR3ALDH1A1MAPTHPGD
SCHEMBL17875158 0.82 ALOX5 (0.44) ALOX5GPR3ALDH1A1MAPTHPGD
SCHEMBL25124895 0.82 KDM4E (0.43) ALOX5GPR3ALDH1A1MAPTHPGD
SCHEMBL15154088 0.82 ALOX5 (0.49) ALOX5GPR3ALDH1A1MAPTHPGD
SCHEMBL12698472 0.82 ALOX5 (0.49) ALOX5GPR3ALDH1A1MAPTHPGD
SCHEMBL20444493 0.81 ALOX5 (0.34) ALOX5POLBS1PR4S1PR5
SCHEMBL22077548 0.80 ALOX5 (0.37) ALOX5GPR3ALDH1A1MAPTHPGD

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-11711973-B2 Organic electronic device DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 US disclosed