SCHEMBL24890101

SCHEMBL24890101

c1ccc(-c2ccc3oc4cccc(C5=NC(c6ccc7ccc8ccccc8c7c6)NC(c6ccccc6)N5)c4c3c2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 2/20 0.33
▸ PLA2G4A P47712 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ PLA2G10 O15496 1/20 0.32
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ FYN P06241 1/20 0.32
▸ MAPK3 P27361 1/20 0.32
▸ AHR P35869 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ ABCG2 Q9UNQ0 1/20 0.32
▸ PIM1 P11309 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
SCHEMBL24887093 0.92 MEN1 (0.33) KDM4EMAPTHPGDTSHRHSD17B10
SCHEMBL24357313 0.91 ALDH1A1 (0.31) ALDH1A1MAPTCYP1A1
SCHEMBL24907720 0.91 — —
SCHEMBL24890057 0.88 KDM4E (0.31) KDM4EALDH1A1MAPTHPGDALOX15
SCHEMBL24890106 0.88 ALDH1A1 (0.34) PLA2G2APLA2G4AALDH1A1MAPTCYP1A1
SCHEMBL24890176 0.88 MEN1 (0.32) ALDH1A1MAPTKMT2A
SCHEMBL24356701 0.88 PLA2G2A (0.32) PLA2G2APLA2G4AALDH1A1MAPTPLA2G10
SCHEMBL24907724 0.88 HCRTR1 (0.31) —
SCHEMBL24634338 0.87 ALDH1A1 (0.33) PLA2G2APLA2G4AALDH1A1MAPTPLA2G10
SCHEMBL24887092 0.87 TDP1 (0.33) KMT2A

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-2023287228-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2023-01-19 — — WO disclosed
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