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Sugi Predict / Compounds / SCHEMBL29129080

SCHEMBL29129080

SCHEMBL29129080

CC(C)CC(NC(=O)C(C)NC(=O)C(Cc1ccccc1)NC(=O)c1ccc(C(C)(C)C)cc1)C(=O)NC(CCCCN)C(=O)NC(CO)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CDYL2 Q8N8U2 6/20 0.70
▸ CBX7 O95931 4/20 0.70
▸ CBX8 Q9HC52 4/20 0.70
▸ CBX4 O00257 3/20 0.70
▸ CBX6 O95503 1/20 0.61
▸ CBX2 Q14781 1/20 0.61
▸ KISS1R Q969F8 1/20 0.49
▸ OPRK1 P41145 5/20 0.48
▸ OPRM1 P35372 2/20 0.46
▸ FOLH1 Q04609 2/20 0.46
▸ PSMB5 P28074 2/20 0.45
▸ CTSL P07711 1/20 0.44

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
SCHEMBL29129077 1.00 CDYL2 (0.70) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL29613457 0.93 CDYL2 (0.79) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL24510644 0.92 CDYL2 (0.72) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL29613443 0.92 CDYL2 (0.70) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL24510642 0.90 CDYL2 (0.68) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL24510752 0.89 CDYL2 (0.78) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL23815561 0.89 CDYL2 (0.78) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL29129083 0.84 CDYL2 (0.56) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL29613538 0.84 CDYL2 (0.70) CDYL2CBX7CBX8CBX4CBX6
SCHEMBL27231641 0.83 CDYL2 (0.66) CDYL2CBX7CBX8CBX4CBX6

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
CN-117279636-A Methods and compounds for modulating myotonic muscular dystrophy type 1 设计治疗公司 2023-12-22 — — CN disclosed