SCHEMBL25872123

SCHEMBL25872123

c1ccc(-c2ccc(N(c3ccc(-c4cc5oc6ccccc6c5c5ccccc45)cc3)c3ccc4c(c3)sc3ccccc34)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PLA2G2A P14555 2/20 0.33
PLA2G4A P47712 2/20 0.33
GPR3 P46089 1/20 0.32
WEE1 P30291 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP1B1 Q16678 1/20 0.32
F9 P00740 1/20 0.31
TNKS O95271 1/20 0.30
ABCB1 P08183 1/20 0.30
CDC14B O60729 1/20 0.30
CDC14A Q9UNH5 1/20 0.30
PLA2G10 O15496 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
SCHEMBL25872497 0.96 PLA2G2A (0.33) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL26588049 0.95 MAPT (0.34) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL26588407 0.95 MAPT (0.34) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL25872762 0.93 ALDH1A1 (0.34) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL25517690 0.93 GPR3 (0.32) MAPTPLA2G2APLA2G4AGPR3CYP1A2
SCHEMBL25599830 0.93 HPGD (0.35) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL26588330 0.92 ALDH1A1 (0.35) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL26588548 0.91 PLA2G2A (0.33) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL25872770 0.91 F9 (0.36) MAPTALDH1A1HPGDRAB9ASMN1; SMN2
SCHEMBL17721427 0.91 F9 (0.36) MAPTALDH1A1HPGDRAB9ASMN1; SMN2

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
WO-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 WO disclosed