SCHEMBL8037952

SCHEMBL8037952

NC(=S)N/N=C(/CNC(=O)Cc1ccccc1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSL P07711 7/20 0.69
MAPT P10636 1/20 0.61
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 1/20 0.56
LMNA P02545 1/20 0.56
GAA P10253 1/20 0.56
HTT P42858 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
ATM Q13315 1/20 0.47
METTL3 Q86U44 1/20 0.47
CTSB P07858 3/20 0.46
CTSK P43235 1/20 0.46

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
SCHEMBL8037956 1.00 CTSL (0.69) CTSLMAPTKMT2AALDH1A1LMNA
SCHEMBL8037941 0.83 CTSL (0.59) CTSLMAPTALDH1A1GAASMN1; SMN2
SCHEMBL8037943 0.83 CTSL (0.59) CTSLMAPTALDH1A1GAASMN1; SMN2
SCHEMBL27950773 0.82 CTSL (1.00) CTSLKMT2AALDH1A1LMNAGAA
SCHEMBL8038235 0.82 ATM (0.58) CTSLALDH1A1ATMMETTL3CTSB
SCHEMBL8038231 0.82 ATM (0.58) CTSLALDH1A1ATMMETTL3CTSB
SCHEMBL8050447 0.78 CTSL (0.54) CTSLMAPTALDH1A1ATMMETTL3
SCHEMBL8050449 0.78 CTSL (0.54) CTSLMAPTALDH1A1ATMMETTL3
SCHEMBL940571 0.78 CTSL (0.54) CTSLMAPTGAAATMMETTL3
SCHEMBL7169655 0.77 CTSL (0.64) CTSLMAPTKMT2AALDH1A1GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6049006-A INCREASES PLASMA LEVELS OF HDL CHOLESTEROL AND AS SUCH USED FOR TREATING DISEASES SUCH AS ATHEROSCLEROSIS AMERICAN HOME PRODUCTS CORP. (US) 2000-04-11 US claimed
US-6049006-A INCREASES PLASMA LEVELS OF HDL CHOLESTEROL AND AS SUCH USED FOR TREATING DISEASES SUCH AS ATHEROSCLEROSIS AMERICAN HOME PRODUCTS CORP. (US) 2000-04-11 US disclosed
WO-1998057926-A1 ELEVATION OF HDL CHOLESTEROL BY N-[2-[ (AMINOTHIOXOMETHYL)HYDRAZONO] -2-ARYLETHYL]AMIDES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-12-23 WO disclosed