SCHEMBL31298666

SCHEMBL31298666

CC(C)Cc1ccc(CCCC(=O)NCCCCC(NC(=O)C(CCCCNC(=O)OC(C)(C)C)NC(=O)CCOCCOCCOCCN)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 4/20 0.44
▸ CA2 P00918 4/20 0.44
▸ TDP1 Q9NUW8 5/20 0.41
▸ PAX8 Q06710 2/20 0.41
▸ POLB P06746 3/20 0.40
▸ NPSR1 Q6W5P4 3/20 0.40
▸ ATM Q13315 2/20 0.40
▸ ALB P02768 3/20 0.40
▸ CALCRL Q16602 1/20 0.39
▸ MMP1 P03956 1/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ PSMB1 P20618 2/20 0.39
▸ PSMB5 P28074 2/20 0.39
▸ PSMB2 P49721 2/20 0.39
▸ MEN1 O00255 2/20 0.38

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
SCHEMBL30783476 0.94 ALB (0.44) CA1CA2TDP1PAX8POLB
SCHEMBL27262252 0.89 CA1 (0.43) CA1CA2TDP1PAX8POLB
SCHEMBL31298652 0.89 KLK7 (0.45) TDP1PAX8MMP1MMP3MMP9
SCHEMBL27262184 0.86 CD40 (0.45) ALBCALCRL
SCHEMBL30783519 0.86 SIRT2 (0.46) TDP1PAX8MAPTPSMB1PSMB5
SCHEMBL30783460 0.86 CPB1 (0.52) CALCRL
SCHEMBL31298682 0.85 PTPN1 (0.41) CA1CA2TDP1PAX8MMP1
SCHEMBL31298662 0.85 CA1 (0.47) CA1CA2TDP1PAX8POLB
SCHEMBL30783467 0.85 ALB (0.40) CA1CA2ALBCALCRL
SCHEMBL30783480 0.84 GLP1R (0.49) TDP1POLBNPSR1ATMMAPT

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-2025029608-A1 FIBROBLAST ACTIVATION PROTEIN-TARGETED COMPOSITIONS AND METHODS OF USE THEREOF RATIO THERAPEUTICS, INC. (US) 2025-02-06 — — WO disclosed
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