SCHEMBL8428302

SCHEMBL8428302

COc1ccc(/C(CCCCl)=N/NC(N)=S)cc1

nearest known ligand 0.73

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSL P07711 3/20 0.55
CTSK P43235 2/20 0.55
EGFR P00533 3/20 0.50

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
SCHEMBL8428303 1.00 CTSL (0.55) CTSLCTSKEGFR
SCHEMBL8426077 0.85 CTSL (0.55) CTSLEGFR
SCHEMBL8426079 0.85 CTSL (0.55) CTSLEGFR
SCHEMBL8428408 0.83 CTSL (0.51) CTSL
SCHEMBL8428406 0.83 CTSL (0.51) CTSL
SCHEMBL8428098 0.83 CTSL (0.51) CTSLEGFR
SCHEMBL8428101 0.83 CTSL (0.51) CTSLEGFR
SCHEMBL8426262 0.83 CTSL (0.66) CTSL
SCHEMBL8426264 0.83 CTSL (0.66) CTSL
SCHEMBL6232192 0.81 CTSK (0.60) CTSLCTSKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6008362-A TREATING ATHEROSCLEROSIS IN MAMMALS WYETH 1999-12-28 US claimed
WO-1998057928-A1 ELEVATION OF HDL CHOLESTEROL BY 2-(4-CHLORO -1-ARYL-BUTYLIDENE) -HYDRAZINECARBOTHIOAMIDES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-12-23 WO claimed
US-6008362-A TREATING ATHEROSCLEROSIS IN MAMMALS WYETH 1999-12-28 US disclosed
WO-1998057928-A1 ELEVATION OF HDL CHOLESTEROL BY 2-(4-CHLORO -1-ARYL-BUTYLIDENE) -HYDRAZINECARBOTHIOAMIDES AMERICAN HOME PRODUCTS CORPORATION (US) 1998-12-23 WO disclosed