SCHEMBL30569417

SCHEMBL30569417

Cc1oc2ccc(OCc3ccccc3)cc2c1C(=O)N1CCC(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.58
SENP8 Q96LD8 1/20 0.58
SENP7 Q9BQF6 1/20 0.58
SENP6 Q9GZR1 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.52
SLC26A4 O43511 6/20 0.49
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.49
BLM P54132 1/20 0.49
ATM Q13315 1/20 0.49
MAPT P10636 3/20 0.47
LTB4R Q15722 1/20 0.45
LTB4R2 Q9NPC1 1/20 0.45
KDM4E B2RXH2 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL29104633 1.00 CASP3 (0.58) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL24470923 0.89 CASP3 (0.64) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL30569470 0.87 CASP3 (0.55) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL24470598 0.87 CASP3 (0.55) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL24470543 0.86 CASP3 (0.66) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL24470555 0.86 CASP3 (0.64) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL29713056 0.86 CASP3 (0.64) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL24470576 0.83 CASP3 (0.69) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL24470580 0.82 CASP3 (0.68) CASP3SENP8SENP7SENP6L3MBTL1
SCHEMBL24470590 0.82 CASP3 (0.68) CASP3SENP8SENP7SENP6L3MBTL1

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
CN-116761796-A Aryl derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2023-09-15 CN disclosed