SCHEMBL25008065

SCHEMBL25008065

O=C(CCC1CCCCC1)N[C@H](CO)C[C@@H]1CCNC1=O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.42
▸ HPGD P15428 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ CTSL P07711 1/20 0.38
▸ CTSB P07858 1/20 0.38
▸ ALPL P05186 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL30222931 0.83 — —
SCHEMBL30913963 0.80 CCR2 (0.49) NAAAMEN1KMT2A
SCHEMBL24690554 0.79 — —
SCHEMBL23883277 0.78 CTSL (0.50) CTSLCTSB
SCHEMBL23883282 0.78 CTSL (0.50) CTSLCTSB
SCHEMBL23883281 0.78 CTSL (0.50) CTSLCTSB
SCHEMBL19924782 0.77 CTSL (0.36) CTSLCTSB
SCHEMBL6064485 0.77 CTSL (0.36) CTSLCTSB
SCHEMBL7417089 0.77 CTSL (0.36) CTSLCTSB
SCHEMBL30913978 0.76 CTSL (0.49) 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
WO-2023014758-A1 INHIBITORS FOR CORONAVIRUSES COCRYSTAL PHARMA, INC. (US) 2023-02-09 — — WO disclosed
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