SCHEMBL24154585

SCHEMBL24154585

c1ccc(N(c2ccccc2)c2cccc3c(N(c4ccc5c(c4)sc4ccccc45)c4ccc5sc6ccccc6c5c4)cccc23)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GPR3 P46089 1/20 0.40
CYP1A2 P05177 1/20 0.36
PTPN7 P35236 1/20 0.35
DUSP3 P51452 1/20 0.35
PTPN12 Q05209 1/20 0.35
PTPN22 Q9Y2R2 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
POLB P06746 1/20 0.34
PTGIR P43119 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MMP12 P39900 2/20 0.31
MMP13 P45452 2/20 0.31
DHODH Q02127 1/20 0.30
GABRP O00591 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
SCHEMBL26851690 0.94 ALDH1A1 (0.44) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL26853327 0.94 MAPT (0.37) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL19429106 0.93 MAPT (0.42) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL19660806 0.92 ALDH1A1 (0.38) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL21281804 0.92 ALDH1A1 (0.38) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL21128428 0.92 ALDH1A1 (0.38) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL22161409 0.92 ALDH1A1 (0.38) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL23515790 0.92 ALDH1A1 (0.38) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL18159296 0.92 GPR3 (0.38) MAPTALDH1A1RAB9AHPGDSMN1; SMN2
SCHEMBL19433280 0.91 ALDH1A1 (0.35) MAPTALDH1A1RAB9AHPGDSMN1; 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-2021261962-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2021-12-30 WO disclosed