SCHEMBL16398142

SCHEMBL16398142

NC[C@H]1CC[C@H](COCc2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
CTSK P43235 1/20 0.50
TAAR1 Q96RJ0 1/20 0.49
TSHR P16473 1/20 0.48
NAAA Q02083 1/20 0.43
DRD1 P21728 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL5526821 1.00 CTSL (0.50) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL5526823 1.00 CTSL (0.50) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL1928095 0.91 TSHR (0.58) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL17019782 0.91 TSHR (0.58) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL23744979 0.86 CTSL (0.50) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL29197662 0.86 CTSL (0.50) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL6748142 0.84 CTSL (0.51) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL6649338 0.83 TSHR (0.54) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL4677170 0.83 TSHR (0.54) CTSLCTSBCTSKTAAR1TSHR
SCHEMBL17043033 0.82 CTSL (0.50) CTSLCTSBCTSKTSHRNAAA

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
WO-2014196328-A1 HYDROXAMIC ACID DERIVATIVE OR SALT THEREOF 日本理化学工業株式会社 (JP) 2014-12-11 WO disclosed