SCHEMBL20233644

SCHEMBL20233644

COCCOCCOCC(=O)NI

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.41
AKT1 P31749 1/20 0.38
TSHR P16473 1/20 0.34
HPGD P15428 1/20 0.34
GAA P10253 1/20 0.34
CA2 P00918 1/20 0.32
OPRM1 P35372 2/20 0.32
ABCB11 O95342 1/20 0.32
CYP3A4 P08684 1/20 0.32
ADRA2B P18089 1/20 0.32
OPRD1 P41143 1/20 0.32
SCN5A Q14524 1/20 0.32
EPHX2 P34913 2/20 0.31
POLB P06746 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL20330002 0.98 NAMPT (0.42) NAMPTAKT1TSHRHPGDGAA
SCHEMBL20330072 0.94 NAMPT (0.39) NAMPTAKT1TSHRHPGDGAA
SCHEMBL20330007 0.90 TSHR (0.39) NAMPTAKT1TSHRHPGDGAA
SCHEMBL20322406 0.90 TSHR (0.39) NAMPTAKT1TSHRHPGDGAA
SCHEMBL20231530 0.88 TSHR (0.40) NAMPTAKT1TSHRHPGDGAA
SCHEMBL23664707 0.84 ALDH1A1 (0.44) NAMPTTSHRGAACYP3A4EPHX2
SCHEMBL20323702 0.84 ALDH1A1 (0.44) NAMPTTSHRGAACYP3A4EPHX2
SCHEMBL21341880 0.83 TSHR (0.38) NAMPTAKT1TSHRHPGDCA2
SCHEMBL18798882 0.81 TPI1 (0.43) NAMPTAKT1TSHRHPGDCA2
SCHEMBL20231387 0.81 NAMPT (0.39) NAMPTAKT1TSHRGAACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023097251-A1 OLIGONUCLEOTIDE-CONTAINING TRANSCRIPTION FACTOR TARGETING CHIMERAS YALE UNIVERSITY (US) 2023-06-01 WO disclosed
EP-3689868-A1 TETRAHYDRONAPHTHALENE AND TETRAHYDROISOQUINOLINE DERIVATIVES AS ESTROGEN RECEPTOR DEGRADERS Arvinas Operations, Inc. (US) 2020-08-05 EP disclosed
WO-2020023851-A1 BIFUNCTIONAL SUBSTITUED PYRIMIDINES AS MODULATORS OF FAK PROTEOLYSE YALE UNIVERSITY (US) 2020-01-30 WO disclosed
WO-2019199816-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME ARVINAS OPERATIONS, INC. (US) 2019-10-17 WO disclosed
WO-2018119441-A9 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2019-10-10 WO disclosed
WO-2018144649-A1 CEREBLON LIGANDS AND BIFUNCTIONAL COMPOUNDS COMPRISING THE SAME Arvinas, Inc. (US) 2018-08-09 WO disclosed
WO-2018119441-A1 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE Arvinas, Inc. (US) 2018-06-28 WO disclosed
WO-2018119448-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF RAPIDLY ACCELERATED FIBROSARCOMA POLYPEPTIDES Arvinas, Inc. (US) 2018-06-28 WO disclosed
WO-2018119357-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ENHANCER OF ZESTE HOMOLOG 2 POLYPEPTIDE Arvinas, Inc. (US) 2018-06-28 WO disclosed
WO-2018102067-A2 TAU-PROTEIN TARGETING PROTACS AND ASSOCIATED METHODS OF USE Arvinas, Inc. (US) 2018-06-07 WO disclosed