SCHEMBL23903290

SCHEMBL23903290

CSCCNC(=O)C(C)(c1ccccc1)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.61
CNR2 P34972 3/20 0.61
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54
NPC1 O15118 3/20 0.53
RAB9A P51151 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
HPGD P15428 3/20 0.53
TP53 P04637 1/20 0.53
NFKB1 P19838 1/20 0.53
MAPK1 P28482 1/20 0.53

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
SCHEMBL25443467 0.86 NPC1 (0.63) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL25443355 0.84 CNR1 (0.58) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL23903504 0.83 CNR1 (0.61) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL6435539 0.81 CNR1 (0.67) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL23903534 0.80 CNR1 (0.65) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL23903561 0.80 CNR1 (0.53) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL6431976 0.79 CNR1 (0.63) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL25442168 0.77 CNR1 (0.75) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL6432059 0.77 CNR1 (0.61) CNR1CNR2HDAC3HDAC4HDAC1
SCHEMBL27426269 0.77 CNR1 (0.61) CNR1CNR2HDAC3HDAC4HDAC1

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-2021203016-A2 PROTEIN-PROTEIN INTERACTION STABILIZERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-10-07 WO disclosed