SCHEMBL8917869

SCHEMBL8917869

CSC1(O)C=CC=CC1C(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
ALOX15 P16050 1/20 0.33
HBB P68871 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 2/20 0.33
EPHX1 P07099 1/20 0.33
CES2 O00748 2/20 0.31
CES1 P23141 2/20 0.31
DAO P14920 1/20 0.31
TSHR P16473 1/20 0.31
NAPRT Q6XQN6 1/20 0.31
ACHE P22303 1/20 0.30
MCL1 Q07820 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
SCHEMBL28014454 0.80 NPC1 (0.42) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL1828048 0.79 L3MBTL1 (0.41) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL9178594 0.79 L3MBTL1 (0.46) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL6938598 0.76 L3MBTL1 (0.39) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL29091452 0.76 NPC1 (0.40) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL2805922 0.76 NPC1 (0.40) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL7851780 0.76 L3MBTL1 (0.41) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL29067489 0.75 NPC1 (0.41) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL4621722 0.74 NPC1 (0.40) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL10959754 0.74 NPC1 (0.40) NPC1L3MBTL1HTTSMN1; SMN2MAPT

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-5684131-A Substituted benzhydrylamines as handles for solid phase peptide synthesis LEBL MICHAL (US) 1997-11-04 US disclosed