SCHEMBL31468372

SCHEMBL31468372

N#Cc1ccc(C(=O)NCc2nccs2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.50
▸ ROCK2 O75116 1/20 0.49
▸ PSMD14 O00487 1/20 0.48
▸ STAMBP O95630 1/20 0.48
▸ COPS5 Q92905 1/20 0.48
▸ EGLN1 Q9GZT9 1/20 0.48
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ ADORA2A P29274 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ SCN3A Q9NY46 1/20 0.45
▸ NAMPT P43490 1/20 0.44
▸ RAB9A P51151 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ KDM1A O60341 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ IDO1 P14902 1/20 0.43
▸ PTPN1 P18031 1/20 0.42

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
SCHEMBL31468361 0.85 PSMD14 (0.53) ROCK2PSMD14STAMBPCOPS5NAMPT
SCHEMBL13102338 0.82 SMN1; SMN2 (0.62) ROCK2PSMD14STAMBPCOPS5MEN1
SCHEMBL13118304 0.81 NPC1 (0.60) ROCK2PSMD14STAMBPCOPS5KMT2A
SCHEMBL1568306 0.81 ROCK2 (0.57) ROCK2PSMD14STAMBPCOPS5KMT2A
SCHEMBL1393311 0.80 NPC1 (0.64) EPHX2ROCK2PSMD14STAMBPCOPS5
SCHEMBL18085951 0.80 ROCK2 (0.58) ROCK2PSMD14STAMBPCOPS5ADORA2A
SCHEMBL3154138 0.78 SCN3A (0.76) EPHX2MEN1KMT2ARXFP1SCN3A
SCHEMBL31468321 0.76 ALDH1A1 (0.44) PSMD14STAMBPCOPS5ADORA2ARAB9A
SCHEMBL14724679 0.76 NR1H4 (0.53) ROCK2PSMD14STAMBPCOPS5MEN1
SCHEMBL7453083 0.76 TRPM5 (0.50) KDM1AKDM4EALDH1A1

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-2025064210-A1 INHIBITORS OF BILIVERDIN REDUCTASE B (BLVRB) BLOOD CELL TECHNOLOGIES, LLC (US) 2025-03-27 — — WO disclosed
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