SCHEMBL23551763

SCHEMBL23551763

CNC(=O)C(CCC=O)Nc1ccc(C2CCNCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.40
▸ JAK3 P52333 1/20 0.38
▸ CTSL P07711 1/20 0.37
▸ CTSB P07858 1/20 0.37
▸ CTSS P25774 1/20 0.37
▸ CTSK P43235 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
SCHEMBL24491308 0.85 KDM1A (0.42) NAMPTJAK3
SCHEMBL23551340 0.81 JAK2 (0.43) JAK3CTSLCTSSCTSK
SCHEMBL27368338 0.77 POLB (0.41) —
SCHEMBL24125410 0.76 NAMPT (0.40) NAMPTJAK3
SCHEMBL27362636 0.74 RAB9A (0.37) —
SCHEMBL24421312 0.73 CTSL (0.33) NAMPTCTSLCTSBCTSSCTSK
SCHEMBL7398684 0.71 NAMPT (0.42) NAMPTJAK3CTSLCTSBCTSS
SCHEMBL24891481 0.71 NAMPT (0.36) NAMPT
SCHEMBL21788531 0.69 SLC18A3 (0.50) NAMPTJAK3
SCHEMBL4764984 0.69 NAMPT (0.56) NAMPTJAK3

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-2021127561-A1 ISOINDOLINONE AND INDAZOLE COMPOUNDS FOR THE DEGRADATION OF EGFR C4 THERAPEUTICS, INC. (US) 2021-06-24 — — WO disclosed
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