SCHEMBL11316366

SCHEMBL11316366

C=CC(=O)OC(C)NC(CCCCC)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 7/20 0.46
CTSL P07711 3/20 0.46
CTSB P07858 3/20 0.46
CTSH P09668 2/20 0.46
CNR2 P34972 1/20 0.41
THRB P10828 2/20 0.40
CSNK1E P49674 1/20 0.40
THRA P10827 1/20 0.39
ALDH1A1 P00352 1/20 0.39
BIRC2 Q13490 1/20 0.39
MMP2 P08253 3/20 0.39
MMP1 P03956 1/20 0.39

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
SCHEMBL11310773 0.99 CTSK (0.45) CTSKCTSLCTSBCTSHCNR2
SCHEMBL11307114 0.99 CTSK (0.45) CTSKCTSLCTSBCTSHCNR2
SCHEMBL11313410 0.96 CTSK (0.49) CTSKCTSLCTSBCTSHCNR2
SCHEMBL11305000 0.92 CTSK (0.43) CTSKCTSLCTSBCTSH
SCHEMBL11304837 0.87 HPGD (0.41) CTSKCTSLCTSBCTSHALDH1A1
SCHEMBL11336581 0.84 TSHR (0.42) CNR2THRBALDH1A1
SCHEMBL11316613 0.82 TSHR (0.41) CNR2THRBTHRA
SCHEMBL11304441 0.82 TSHR (0.41) CNR2THRBTHRA
SCHEMBL11307934 0.82 TSHR (0.41) CNR2THRBTHRA
SCHEMBL11304377 0.82 TSHR (0.41) CNR2THRBTHRA

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-4268602-A Photosensitive O-quinone diazide containing composition TORAY INDUSTRIES, LTD. (JP) 1981-05-19 US disclosed