Sugi Predict

Sugi Predict / Compounds / SCHEMBL24949880

SCHEMBL24949880

SCHEMBL24949880

c1ccc(-c2ccc(N(c3ccc(-c4c(-c5ccccc5)cccc4-n4c5ccccc5c5ccccc54)cc3)c3ccc(-c4ccccc4)c(-c4ccccc4)c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK14 Q16539 1/20 0.31
▸ TSPO P30536 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL26487862 1.00 ALDH1A1 (0.33) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL26487745 0.94 ALDH1A1 (0.37) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL26488094 0.93 ALDH1A1 (0.33) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL17702807 0.93 ALDH1A1 (0.38) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL24902349 0.93 ALDH1A1 (0.38) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL26487727 0.93 ALDH1A1 (0.38) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL26488352 0.92 ALDH1A1 (0.32) ALDH1A1
SCHEMBL26488100 0.92 ALDH1A1 (0.34) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL26487704 0.92 ALDH1A1 (0.34) ALDH1A1MAPK14TSPOKDM4EATM
SCHEMBL26488011 0.92 ALDH1A1 (0.34) ALDH1A1MAPK14TSPOKDM4EATM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 — — WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 — — WO disclosed