SCHEMBL27361693

SCHEMBL27361693

c1ccc(-c2cccc(N(c3ccc(-c4ccccc4-n4c5ccccc5c5ccccc54)c(-c4ccccc4)c3)c3ccccc3-c3ccc(-c4ccccc4)c4ccccc34)c2)cc1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31

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
SCHEMBL27361691 0.94 ALDH1A1 (0.33) MAPK14ALDH1A1
SCHEMBL27361692 0.93 ALDH1A1 (0.32) MAPK14ALDH1A1
SCHEMBL27360930 0.92 CA12 (0.36) —
SCHEMBL27360927 0.92 CA12 (0.36) —
SCHEMBL27361828 0.91 MAPK14 (0.31) MAPK14ALDH1A1
SCHEMBL27361957 0.91 ALDH1A1 (0.31) ALDH1A1
SCHEMBL24947375 0.91 MAPK14 (0.33) MAPK14ALDH1A1
SCHEMBL27361834 0.90 MAPK14 (0.31) MAPK14ALDH1A1
SCHEMBL27011992 0.90 MAPK14 (0.32) MAPK14ALDH1A1
SCHEMBL27361660 0.90 TSPO (0.34) MAPK14ALDH1A1

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-2024014660-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2024-01-18 — — WO disclosed
Send feedback