SCHEMBL19334264

SCHEMBL19334264

CCC(C)C(=O)C1(NC(=O)OC)CCCC1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MME P08473 1/20 0.31
FAAH O00519 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
CTSL P07711 1/20 0.30
CTSB P07858 1/20 0.30
CTSS P25774 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL19578129 0.93 HSD17B10 (0.31)
SCHEMBL8912335 0.82 MAPT (0.36) MAPTALDH1A1L3MBTL1FAAHTRPV1
SCHEMBL18782846 0.80 TSHR (0.32) L3MBTL1MME
SCHEMBL19364749 0.79 MAPT (0.34) MAPTALDH1A1L3MBTL1FAAHTRPV1
SCHEMBL8908048 0.79 MAPT (0.33) MAPTALDH1A1L3MBTL1FAAHTRPV1
SCHEMBL19364820 0.76 MAPT (0.31) MAPT
SCHEMBL8915997 0.75 MAPT (0.36) MAPTALDH1A1L3MBTL1FAAHTRPV1
SCHEMBL19334261 0.75 MAPT (0.33) MAPTALDH1A1L3MBTL1FAAHTRPV1
SCHEMBL890104 0.74
SCHEMBL19388266 0.74 CTSL (0.32) CTSLCTSB

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-9758487-B2 Hepatitis C virus inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-09-12 US disclosed