SCHEMBL22901084

SCHEMBL22901084

c1ccc(C2=NC(c3cccc(-c4cccc(-c5cccc6c5ccc5sc7ccccc7c56)c4)c3)NC(c3ccccc3)N2)cc1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F9 P00740 1/20 0.31
▸ P2RX7 Q99572 2/20 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
SCHEMBL22901082 0.87 — —
SCHEMBL21305038 0.85 — —
SCHEMBL20865454 0.83 ALOX5 (0.40) P2RX7
SCHEMBL18697621 0.83 P2RX7 (0.34) P2RX7
SCHEMBL22240821 0.82 ALOX5 (0.32) —
SCHEMBL18767356 0.81 MEN1 (0.30) —
SCHEMBL22825260 0.80 P2RX7 (0.32) P2RX7
SCHEMBL24232403 0.79 — —
SCHEMBL25731717 0.79 — —
SCHEMBL25731591 0.79 — —

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
US-20210020849-A1 PLURALITY OF HOST MATERIALS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2021-01-21 — — US disclosed
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