SCHEMBL29067489

SCHEMBL29067489

CC1(Cl)C=CC=CC1C(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 3/20 0.35
ALOX15 P16050 1/20 0.35
HBB P68871 1/20 0.35
EPHX1 P07099 1/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 3/20 0.34
CES2 O00748 2/20 0.32
CES1 P23141 2/20 0.32
DAO P14920 1/20 0.32
TSHR P16473 1/20 0.32
NAPRT Q6XQN6 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL4621722 0.83 NPC1 (0.40) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL28014454 0.82 NPC1 (0.42) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL31050429 0.78 NPC1 (0.40) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL7851780 0.78 L3MBTL1 (0.41) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL1828048 0.78 L3MBTL1 (0.41) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL28359455 0.78 NPC1 (0.37) NPC1L3MBTL1SMN1; SMN2MAPTALOX15
SCHEMBL7787651 0.77 NPC1 (0.39) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL31157635 0.77 NPC1 (0.39) NPC1L3MBTL1HTTSMN1; SMN2MAPT
SCHEMBL1993413 0.77
SCHEMBL10959754 0.76 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116730817-A Preparation method of photoinitiator 1173 天津久日新材料股份有限公司 2023-09-12 CN claimed
CN-116730817-A Preparation method of photoinitiator 1173 天津久日新材料股份有限公司 2023-09-12 CN disclosed