SCHEMBL23891762

SCHEMBL23891762

CC(=O)CCC(NC(=O)OC(C)(C)C)C1CCC(C)(F)CC1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 10/20 0.34
CTSS P25774 2/20 0.34
HDAC4 P56524 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
TSHR P16473 1/20 0.33
FSHR P23945 1/20 0.33
KMT2A Q03164 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CTSL P07711 1/20 0.33
PLG P00747 1/20 0.32
APLNR P35414 1/20 0.32
AAK1 Q2M2I8 1/20 0.32

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
SCHEMBL23878337 0.91 CA1 (0.37) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL22039489 0.91 CA1 (0.37) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL23891780 0.88 CTSK (0.35) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL23878305 0.80 KMT2A (0.37) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL22039736 0.80 KMT2A (0.37) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL25321256 0.76 CTSK (0.42) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL25321261 0.76 CTSK (0.42) CTSKCTSSHDAC4HDAC1HDAC6
SCHEMBL30953384 0.76 AAK1 (0.39) CTSKCTSSKMT2ACA1CA2
SCHEMBL31094703 0.76 AAK1 (0.39) CTSKCTSSKMT2ACA1CA2
SCHEMBL28027174 0.76 P2RX7 (0.44) CTSKCTSSHDAC4HDAC1HDAC6

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
EP-3889138-A1 HISTONE ACETYLASE P300 INHIBITOR AND USE THEREOF Hinova Pharmaceuticals Inc. (CN) 2021-10-06 EP disclosed