SCHEMBL25884530

SCHEMBL25884530

c1ccc2c(-c3ccc(N(c4ccc(-c5cc6sc7ccccc7c6c6ccccc56)cc4)c4cccc5oc6ccccc6c45)cc3)cccc2c1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.34
▸ CA1 P00915 3/20 0.34
▸ CA2 P00918 3/20 0.34
▸ CA9 Q16790 3/20 0.34
▸ PRKDC P78527 1/20 0.31
▸ ENPP3 O14638 1/20 0.31
▸ ENPP1 P22413 1/20 0.31
▸ F9 P00740 1/20 0.31
▸ ELANE P08246 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
SCHEMBL22523494 0.91 CA12 (0.33) CA12CA1CA2CA9PRKDC
SCHEMBL25882503 0.90 CA12 (0.31) CA12CA1CA2CA9PRKDC
SCHEMBL22523583 0.90 CA12 (0.33) CA12CA1CA2CA9PRKDC
SCHEMBL23867376 0.89 CA12 (0.34) CA12CA1CA2CA9PRKDC
SCHEMBL25882513 0.89 CA12 (0.33) CA12CA1CA2CA9PRKDC
SCHEMBL23867433 0.89 F9 (0.33) CA12CA1CA2CA9PRKDC
SCHEMBL23867226 0.89 CA12 (0.32) CA12CA1CA2CA9PRKDC
SCHEMBL25883507 0.88 TDP1 (0.33) F9
SCHEMBL25884442 0.88 CA12 (0.34) CA12CA1CA2CA9PRKDC
SCHEMBL22523641 0.88 CA12 (0.34) CA12CA1CA2CA9PRKDC

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
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