SCHEMBL8536561

SCHEMBL8536561

Cc1nccc2[nH]c(CO[Si](C)(C)C(C)(C)C)nc12

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDE3B Q13370 2/20 0.31
PDE3A Q14432 2/20 0.31
CACNA1H O95180 1/20 0.31
DUT P33316 2/20 0.30
MAOA P21397 1/20 0.30
DYRK1A Q13627 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30

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
SCHEMBL5201596 0.80 MGAM (0.43) NPC1RAB9ACACNA1H
SCHEMBL7833147 0.74 NPC1 (0.35) NPC1RAB9ASMN1; SMN2
SCHEMBL5214411 0.71 NPC1 (0.55) NPC1RAB9ASMN1; SMN2
SCHEMBL13508627 0.70 KMT2A (0.54) NPC1RAB9ASMN1; SMN2
SCHEMBL7464101 0.70 MPO (0.32)
SCHEMBL2908964 0.68 CACNA1H (0.37) NPC1RAB9ASMN1; SMN2PDE3BPDE3A
SCHEMBL7470600 0.68 NPC1 (0.32) NPC1RAB9ASMN1; SMN2DUT
SCHEMBL18576287 0.67 PDE3B (0.43) SMN1; SMN2PDE3BPDE3AMAOA
SCHEMBL5864464 0.67 CYP2C9 (0.42) DUT
SCHEMBL18663573 0.67 GAA (0.56) RAB9ASMN1; SMN2CACNA1H

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
US-5739345-A HYPOGLYCEMIC AND ANTIDIABETIC AGENTS SANKYO COMPANY, LIMITED (JP) 1998-04-14 US disclosed