SCHEMBL24551369

SCHEMBL24551369

Clc1ccc2oc3cc4sc(-c5ccccc5)nc4cc3c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ HPGD P15428 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ CASP3 P42574 2/20 0.45
▸ SENP7 Q9BQF6 2/20 0.45
▸ SENP6 Q9GZR1 2/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ GLA P06280 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ AHR P35869 3/20 0.44
▸ APP P05067 2/20 0.44
▸ ADORA3 P0DMS8 2/20 0.43
▸ NFKB1 P19838 2/20 0.43
▸ NFKB2 Q00653 2/20 0.43
▸ RELA Q04206 2/20 0.43
▸ LMNA P02545 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
SCHEMBL24552789 0.97 APP (0.45) SMN1; SMN2KDM4EHPGDALDH1A1CASP3
SCHEMBL24550447 0.95 SMN1; SMN2 (0.45) SMN1; SMN2KDM4EHPGDALDH1A1CASP3
SCHEMBL24550963 0.92 AHR (0.48) SMN1; SMN2KDM4EHPGDALDH1A1CASP3
SCHEMBL24551290 0.90 AHR (0.46) SMN1; SMN2KDM4EHPGDALDH1A1CASP3
SCHEMBL24552326 0.87 AHR (0.48) SMN1; SMN2KDM4EHPGDALDH1A1CASP3
SCHEMBL24551970 0.85 AHR (0.46) SMN1; SMN2KDM4EHPGDALDH1A1CASP3
SCHEMBL24551558 0.83 AHR (0.54) SMN1; SMN2KDM4EALDH1A1MEN1GAA
SCHEMBL24552134 0.83 APP (0.43) SMN1; SMN2CASP3SENP7SENP6MAPT
SCHEMBL29023857 0.81 SMN1; SMN2 (0.49) SMN1; SMN2KDM4EHPGDALDH1A1CASP3
SCHEMBL30399025 0.81 SMN1; SMN2 (0.49) SMN1; SMN2KDM4EHPGDALDH1A1CASP3

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-2022131869-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-23 — — WO disclosed
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