SCHEMBL31468331

SCHEMBL31468331

O=C(O)c1cccc(-c2nc(-c3ccccc3F)c3sccn23)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.49
BLVRB P30043 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
TNK2 Q07912 2/20 0.43
HSD17B10 Q99714 1/20 0.39
NR1H4 Q96RI1 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CSNK2A2 P19784 1/20 0.39
CSNK2B P67870 1/20 0.39
KMO O15229 1/20 0.38
RORC P51449 2/20 0.37
BTK Q06187 1/20 0.37
LDHA P00338 1/20 0.37
MAPK14 Q16539 1/20 0.37
STIM1 Q13586 1/20 0.36
ORAI1 Q96D31 1/20 0.36

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
SCHEMBL31468428 0.88 TNK2 (0.41) MAOABLVRBHDAC6TNK2HSD17B10
SCHEMBL31468406 0.87 TNK2 (0.43) MAOABLVRBHDAC6TNK2HSD17B10
SCHEMBL31468362 0.85 TNK2 (0.43) TNK2HSD17B10NR1H4NPC1RAB9A
SCHEMBL31468426 0.82 SMN1; SMN2 (0.44) HSD17B10RAB9AMAPK14
SCHEMBL31468298 0.82 TTR (0.39) TNK2NPC1RAB9ARORC
SCHEMBL31468367 0.80 GABRG2 (0.47) HSD17B10
SCHEMBL31468420 0.76 KDM4E (0.43) NPC1RAB9AKMORORC
SCHEMBL31468320 0.76 KDM4E (0.42) TNK2NPC1RAB9AKMORORC
SCHEMBL31468429 0.76 RARA (0.48) TNK2HSD17B10NPC1RAB9ARORC
SCHEMBL31468330 0.75 RORC (0.46) TNK2NR1H4KMORORC

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