SCHEMBL30899481

SCHEMBL30899481

COC(=O)c1ccc2c(C(=O)O)c[nH]c2c1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.66
NR4A2 P43354 8/20 0.61
CREBBP Q92793 1/20 0.54
KIF11 P52732 1/20 0.54
ASH1L Q9NR48 1/20 0.53
CDK2 P24941 1/20 0.51
RAB9A P51151 2/20 0.50
PARP1 P09874 2/20 0.50
EIF2AK2 P19525 1/20 0.49
GPR84 Q9NQS5 1/20 0.49
TUBB1 Q9H4B7 1/20 0.49

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
SCHEMBL4780495 1.00 NPC1 (0.66) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL6418495 0.92 NR4A2 (0.72) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL2493105 0.89 NPC1 (0.64) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL6418497 0.89 NR4A2 (0.68) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL30697204 0.89 NPC1 (0.64) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL4164843 0.88 NPC1 (0.63) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL6332786 0.87 NPC1 (0.61) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL23551106 0.85 NPC1 (0.60) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL3243814 0.85 MAPT (0.67) NPC1NR4A2CREBBPKIF11ASH1L
SCHEMBL7415993 0.85 NPC1 (0.64) NPC1NR4A2CREBBPKIF11ASH1L

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
CN-118108706-A Glutarimide C4医药公司 2024-05-31 CN disclosed
CN-111278815-B Glutarimide C4医药公司 2024-03-08 CN disclosed