SCHEMBL17282224

SCHEMBL17282224

COC(=O)C1CN1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 3/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ FABP7 O15540 2/20 0.45
▸ EPHX2 P34913 1/20 0.43
▸ CASP3 P42574 2/20 0.42
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ PIN1 Q13526 1/20 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
SCHEMBL29855006 1.00 FABP5 (0.46) FABP5KMT2AFABP7EPHX2CASP3
SCHEMBL30861822 1.00 FABP5 (0.46) FABP5KMT2AFABP7EPHX2CASP3
SCHEMBL30278686 1.00 FABP5 (0.46) FABP5KMT2AFABP7EPHX2CASP3
SCHEMBL21895946 1.00 FABP5 (0.46) FABP5KMT2AFABP7EPHX2CASP3
SCHEMBL3783542 0.89 KMT2A (0.43) FABP5KMT2AFABP7EPHX2
SCHEMBL3788777 0.89 KMT2A (0.43) FABP5KMT2AFABP7EPHX2
SCHEMBL4249277 0.89 KMT2A (0.43) FABP5KMT2AFABP7EPHX2
SCHEMBL3789335 0.89 KMT2A (0.43) FABP5KMT2AFABP7EPHX2
SCHEMBL3793423 0.89 KMT2A (0.43) FABP5KMT2AFABP7EPHX2
SCHEMBL3778974 0.88 FABP5 (0.42) FABP5KMT2AFABP7EPHX2CASP3

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118256591-A Cyclic peptide compound having high membrane permeability and library comprising same 中外制药株式会社 2024-06-28 — — CN disclosed
CN-110869544-B Cyclic peptide compound having high membrane permeability and library comprising same 中外制药株式会社 2024-03-08 — — CN disclosed
WO-2020122182-A1 AMINO ACID HAVING FUNCTIONAL GROUP CAPABLE OF INTERMOLECULAR HYDROGEN BONDING, PEPTIDE COMPOUND CONTAINING SAME AND METHOD FOR PRODUCTION THEREOF 中外製薬株式会社 2020-06-18 — — WO disclosed
WO-2020122182-A1 AMINO ACID HAVING FUNCTIONAL GROUP CAPABLE OF INTERMOLECULAR HYDROGEN BONDING, PEPTIDE COMPOUND CONTAINING SAME AND METHOD FOR PRODUCTION THEREOF 中外製薬株式会社 2020-06-18 — — WO disclosed
CN-110869544-A Cyclic peptide compound having high membrane permeability and library containing same 中外制药株式会社 2020-03-06 — — CN disclosed
WO-2015179823-A2 LUNG LOCALIZED INHIBITORS OF ALPHA(V)BETA 6 THE CALIFORNIA INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2015-11-26 — — WO disclosed
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