SCHEMBL10567792

SCHEMBL10567792

CC(C)C(C)(C)[SiH2]Oc1ccc2[nH]ccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.41
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
LTA4H P09960 2/20 0.38
AHR P35869 3/20 0.38
NR4A2 P43354 2/20 0.38
CYP2A6 P11509 2/20 0.38
F7 P08709 1/20 0.38
F3 P13726 1/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
ALOX15 P16050 1/20 0.38
RAD51 Q06609 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAOB P27338 1/20 0.37
PTGS2 P35354 1/20 0.36
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35

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
SCHEMBL3025365 0.73 MAOA (0.55) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL3791624 0.73 MAOA (0.48) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL28962404 0.70 MAOA (0.49) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL74720 0.70 MEN1 (0.71) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL29992449 0.70 MEN1 (0.71) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL19884908 0.70 LTA4H (0.56) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL8047856 0.69 AHR (0.46) LTA4HAHRNR4A2CYP2A6F7
SCHEMBL12250943 0.69 LTA4H (0.51) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL19884909 0.69 LTA4H (0.51) MAOAMEN1POLBMAPK1KMT2A
SCHEMBL7062445 0.69 MTNR1A (0.31) SLC6A4SLC6A3

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
US-4824852-A Substituted indole compounds which have useful effects on the central nervous system MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-04-25 US disclosed
US-4740602-A Indole derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1988-04-26 US disclosed