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Sugi Predict / Compounds / SCHEMBL24315428

SCHEMBL24315428

SCHEMBL24315428

C=C(/C=C\C(=C/C)N(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2-c2cc3ccccc3c3ccccc23)cc1)c1cc2ccccc2c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 2/20 0.33
▸ CYP11B1 P15538 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ MPI P34949 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
SCHEMBL25056876 0.85 GPR84 (0.33) GPR84CYP11B1
SCHEMBL22036430 0.77 SLC6A9 (0.33) —
SCHEMBL23448088 0.72 ALDH1A1 (0.43) GPR84CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL20714834 0.72 ALDH1A1 (0.43) GPR84CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL23448092 0.72 ALDH1A1 (0.43) GPR84CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24221781 0.72 ALDH1A1 (0.43) GPR84CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL24221752 0.72 ALDH1A1 (0.43) GPR84CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL23820835 0.71 CYP11B1 (0.44) GPR84CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL23448100 0.71 ALDH1A1 (0.42) GPR84CYP11B1KDM4EMEN1ALDH1A1
SCHEMBL23448038 0.71 CYP11B1 (0.44) GPR84CYP11B1KDM4EMEN1ALDH1A1

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
EP-3972001-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2022-03-23 — — EP disclosed
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