SCHEMBL30656000

SCHEMBL30656000

COC(=O)c1c(C=O)sc2ccc(OCc3ccccc3)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.51
L3MBTL1 Q9Y468 4/20 0.46
TDP1 Q9NUW8 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
CASP3 P42574 2/20 0.44
SENP8 Q96LD8 2/20 0.44
SENP7 Q9BQF6 2/20 0.44
SENP6 Q9GZR1 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAOB P27338 3/20 0.43
MAOA P21397 2/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
GPR55 Q9Y2T6 1/20 0.42
PLA2G2A P14555 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRG2 P18507 1/20 0.41

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
SCHEMBL26661129 1.00 EDNRA (0.51) EDNRAL3MBTL1TDP1NPC1RAB9A
SCHEMBL2470943 0.82 EDNRA (0.51) EDNRAL3MBTL1TDP1NPC1RAB9A
SCHEMBL26661130 0.81 EDNRA (0.53) EDNRAL3MBTL1TDP1NPC1RAB9A
SCHEMBL31351336 0.81 EDNRA (0.53) EDNRAL3MBTL1TDP1NPC1RAB9A
SCHEMBL31351339 0.79 L3MBTL1 (0.46) L3MBTL1TDP1LMNAHPGDSMN1; SMN2
SCHEMBL26661109 0.79 L3MBTL1 (0.46) L3MBTL1TDP1LMNAHPGDSMN1; SMN2
SCHEMBL15465845 0.78 EDNRA (0.59) EDNRANPC1RAB9ACASP3SENP8
SCHEMBL31351338 0.76 EDNRA (0.60) EDNRAL3MBTL1CASP3SENP8SENP7
SCHEMBL26661119 0.76 EDNRA (0.60) EDNRAL3MBTL1CASP3SENP8SENP7
SCHEMBL31351335 0.75 GABRA1 (0.55) EDNRAL3MBTL1CASP3SENP8SENP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4532013-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS Katholieke Universiteit Leuven KU Leuven Research & Development (BE) 2025-04-09 EP disclosed
CN-119421879-A Novel derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2025-02-11 CN disclosed
WO-2023227697-A1 NEW DERIVATIVES FOR TREATING TRPM3 MEDIATED DISORDERS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2023-11-30 WO disclosed