SCHEMBL23059044

SCHEMBL23059044

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nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 11/20 0.43
▸ CTSS P25774 6/20 0.43
▸ SYK P43405 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA7 P43166 1/20 0.39
▸ ATM Q13315 1/20 0.36
▸ CYP2D6 P10635 1/20 0.35
▸ CTSL P07711 1/20 0.35
▸ CTSB P07858 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TSHR P16473 1/20 0.34

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
SCHEMBL30180879 0.86 CTSK (0.47) CTSKCTSS
SCHEMBL24178454 0.82 CTSK (0.46) CTSKCTSSCA1CA2CA7
SCHEMBL9911449 0.79 CA1 (0.52) CTSKCTSSSYKCA1CA2
SCHEMBL1722314 0.78 CTSS (0.57) CTSKCTSSSYKCA1CA2
SCHEMBL5115667 0.78 CTSS (0.57) CTSKCTSSSYKCA1CA2
SCHEMBL15627225 0.78 CTSK (0.46) CTSKCTSSCA1CA2CA7
SCHEMBL21309491 0.76 CTSK (0.41) CTSKCTSSCA1CA2CA7
SCHEMBL20757550 0.76 CTSK (0.49) CTSKCTSSSYKCA1CA2
SCHEMBL22109892 0.74 CTSK (0.50) CTSKCTSSCA1CA2CA7
SCHEMBL102361 0.74 CTSK (0.47) CTSKCTSSSYKCA1CA2

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-2021041539-A2 COMPOUNDS AND METHODS OF USE Ferro Therapeutics, Inc. (US) 2021-03-04 — — WO disclosed
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