SCHEMBL25875198

SCHEMBL25875198

Nc1ccc(-c2ccccc2-c2ccccc2-c2nc(-c3ccccc3)nc(-c3ccccc3-c3ccccc3-c3nc4ccccc4s3)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.61
▸ MMP9 P14780 1/20 0.61
▸ MMP8 P22894 1/20 0.61
▸ MAPT P10636 10/20 0.54
▸ RAB9A P51151 9/20 0.54
▸ MEN1 O00255 8/20 0.54
▸ KMT2A Q03164 8/20 0.54
▸ KDM4E B2RXH2 8/20 0.54
▸ NPC1 O15118 8/20 0.54
▸ ALDH1A1 P00352 7/20 0.54
▸ GAA P10253 7/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ L3MBTL1 Q9Y468 3/20 0.54
▸ TDP1 Q9NUW8 3/20 0.54
▸ NFKB1 P19838 3/20 0.50
▸ NFKB2 Q00653 3/20 0.50
▸ RELA Q04206 3/20 0.50
▸ POLB P06746 3/20 0.50
▸ THRB P10828 1/20 0.50
▸ ALOX15 P16050 1/20 0.50

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
SCHEMBL25874443 0.88 RAB9A (0.67) APPMMP9MMP8MAPTRAB9A
SCHEMBL25875174 0.85 THRB (0.44) APPMMP9MMP8MAPTRAB9A
SCHEMBL31287309 0.83 RAB9A (0.60) APPMMP9MMP8MAPTRAB9A
SCHEMBL4412613 0.83 RAB9A (0.64) APPMMP9MMP8MAPTRAB9A
SCHEMBL26269087 0.83 APP (0.56) APPMMP9MMP8MAPTRAB9A
SCHEMBL23099274 0.81 APP (0.55) APPMMP9MMP8MAPTRAB9A
2-Phenylbenzo[D]Thiazole SCHEMBL12479300 0.80 APP (0.93) APPMMP9MMP8MAPTRAB9A
SCHEMBL22178377 0.80 RAB9A (0.50) APPMMP9MMP8MAPTRAB9A
SCHEMBL24301080 0.80 MEN1 (0.63) MAPTRAB9AMEN1KMT2AKDM4E
SCHEMBL23099240 0.80 APP (0.54) APPMMP9MMP8MAPTRAB9A

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-2023140649-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-07-27 — — WO disclosed
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