SCHEMBL30474696

SCHEMBL30474696

CS(=N)(=O)Cc1ccc2oc(C(=O)Nc3cc(-c4ccc(F)cc4)ccc3N)cc2c1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 17/20 0.52
HDAC1 Q13547 16/20 0.52
HDAC3 O15379 12/20 0.44
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40

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
SCHEMBL25211739 1.00 HDAC2 (0.52) HDAC2HDAC1HDAC3MEN1NPC1
SCHEMBL31108997 0.93 HDAC2 (0.54) HDAC2HDAC1HDAC3MEN1NPC1
SCHEMBL30474694 0.87 HDAC2 (0.53) HDAC2HDAC1HDAC3MEN1NPC1
SCHEMBL25251306 0.87 HDAC2 (0.53) HDAC2HDAC1HDAC3MEN1NPC1
SCHEMBL25249557 0.83 HDAC2 (0.62) HDAC2HDAC1HDAC3
SCHEMBL25216800 0.82 HDAC2 (0.47) HDAC2HDAC1HDAC3MEN1NPC1
SCHEMBL30474718 0.82 HDAC2 (0.47) HDAC2HDAC1HDAC3MEN1NPC1
SCHEMBL25208867 0.81 HDAC2 (0.49) HDAC2HDAC1HDAC3
SCHEMBL30474830 0.81 HDAC2 (0.49) HDAC2HDAC1HDAC3
SCHEMBL25216935 0.79 HDAC2 (0.49) HDAC2HDAC1HDAC3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4441033-A1 NOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF Tango Therapeutics, Inc. (US) 2024-10-09 EP disclosed
WO-2023102162-A1 TGONOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. (US) 2023-06-08 WO disclosed