SCHEMBL30516210

SCHEMBL30516210

Cc1cc(C)n(-c2cccc(O)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 3/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 5/20 0.46
ADORA2A P29274 1/20 0.46
KAT6A Q92794 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.43
CYP1A2 P05177 1/20 0.43
MAPK1 P28482 1/20 0.43
CYP2C19 P33261 1/20 0.43
HPGD P15428 1/20 0.43
HTR7 P34969 1/20 0.43
HTR2B P41595 1/20 0.43
POLB P06746 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL2616605 1.00 KDM4E (0.50) KDM4EGAAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL11686870 0.83 ALDH1A1 (0.71) ALDH1A1L3MBTL1SMN1; SMN2MAPTRAB9A
SCHEMBL8338087 0.81 ALDH1A1 (0.69) KDM4EGAAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL19215903 0.80 NTRK1 (0.50) GAAALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL597831 0.79 MAPT (0.57) KDM4EGAAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL964125 0.79 MAPK1 (0.66) KDM4EGAAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL1075204 0.79 ALDH1A1 (0.56) KDM4EGAAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL2616607 0.79 SMN1; SMN2 (0.52) GAAALDH1A1L3MBTL1SMN1; SMN2MAPT
SCHEMBL2616606 0.79 ALDH1A1 (0.47) KDM4EGAAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL11969682 0.79 ALDH1A1 (0.47) GAAALDH1A1L3MBTL1SMN1; SMN2MAPT

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-116655699-A Bivalent platinum complex white phosphorus light material and device application thereof 南京佳诺霖光电科技有限公司 2023-08-29 CN disclosed