SCHEMBL8340977

SCHEMBL8340977

Cc1ccc(C(=O)COC(=O)NC(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 6/20 0.54
RAB9A P51151 6/20 0.54
MAPT P10636 3/20 0.54
ALDH1A1 P00352 2/20 0.54
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
TP53 P04637 1/20 0.48
HPGD P15428 1/20 0.48
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
MEN1 O00255 1/20 0.46
POLB P06746 2/20 0.46
TSHR P16473 1/20 0.46
ADRB2 P07550 1/20 0.46
ADRB1 P08588 1/20 0.46
ADRB3 P13945 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 1/20 0.45
GSK3B P49841 1/20 0.44

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
SCHEMBL8341523 0.86 L3MBTL1 (0.49) MAPTALDH1A1KMT2ASMN1; SMN2HPGD
SCHEMBL8335416 0.86 KDM4E (0.47) NPC1RAB9AALDH1A1KMT2AHPGD
SCHEMBL8341968 0.85 NPC1 (0.51) NPC1RAB9AMAPTALDH1A1KMT2A
SCHEMBL8338985 0.84 ESR2 (0.56) NPC1RAB9AMAPTALDH1A1KMT2A
SCHEMBL8339223 0.83 MAPT (0.51) NPC1RAB9AMAPTALDH1A1KMT2A
SCHEMBL8338779 0.81 ALDH1A1 (0.64) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL25893706 0.80 RAB9A (0.60) NPC1RAB9AMAPTALDH1A1KMT2A
SCHEMBL8338666 0.79 ALDH1A1 (0.60) MAPTALDH1A1KMT2ASMN1; SMN2NFKB1
SCHEMBL4549475 0.75 RAB9A (0.64) NPC1RAB9AMAPTALDH1A1KMT2A
SCHEMBL178370 0.75 MEN1 (0.66) NPC1RAB9AMAPTALDH1A1KMT2A

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-5968975-A TREATING ATHEROSCLEROSIS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-19 US disclosed
WO-1998057925-A1 ELEVATION OF HDL CHOLESTEROL BY 2-[(AMINOTHIOXOMETHYL)-HYDRAZONO]-2-ARYLETHYL CARBAMATES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-12-23 WO disclosed