SCHEMBL24949465

SCHEMBL24949465

Clc1cc(-c2ccc3cc(C4NC(c5ccc6c(ccc7ccccc76)c5)=NC(c5ccc6ccccc6c5)N4)ccc3c2)c2c(c1)oc1ccccc12

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ GPR84 Q9NQS5 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
SCHEMBL24890179 0.91 CYP1A1 (0.31) ALDH1A1GPR84
SCHEMBL24949464 0.90 GPR84 (0.30) GPR84
SCHEMBL24886834 0.86 ALDH1A1 (0.32) KDM4EALDH1A1HPGDGPR84
SCHEMBL24973402 0.86 KDM4E (0.32) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL24949577 0.85 KDM4E (0.31) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL24890264 0.83 — —
SCHEMBL24886860 0.83 ALDH1A1 (0.32) ALDH1A1
SCHEMBL24886817 0.83 BACE1 (0.32) ALDH1A1
SCHEMBL24890270 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL24315386 0.82 ALDH1A1 (0.33) ALDH1A1

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