SCHEMBL23729451

SCHEMBL23729451

COCCOCCOCCC(=O)NCCCCC(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
HPGD P15428 4/20 0.42
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 2/20 0.39
EPHX2 P34913 2/20 0.39
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CASP2 P42575 1/20 0.38
PKM P14618 1/20 0.38
GLP1R P43220 3/20 0.37
BRD4 O60885 1/20 0.37
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL14561105 0.96 TSHR (0.51) TSHRHPGDKDM4ELMNAMEN1
SCHEMBL25009847 0.88 TSHR (0.49) TSHRHPGDKDM4ELMNAMEN1
SCHEMBL15463112 0.87 TSHR (0.47) TSHRHPGDKDM4ELMNAMEN1
SCHEMBL26700977 0.87 EPHX2 (0.43) TSHRHPGDLMNAKMT2AALDH1A1
SCHEMBL22473696 0.87 TSHR (0.42) TSHRHPGDMEN1KMT2AALDH1A1
SCHEMBL25536719 0.86 TSHR (0.62) TSHRHPGDKDM4ELMNAMEN1
SCHEMBL18306913 0.86 MEN1 (0.45) TSHRHPGDKDM4ELMNAMEN1
SCHEMBL12834880 0.85 TSHR (0.59) TSHRHPGDKDM4ELMNAMEN1
SCHEMBL23319057 0.85 HPGD (0.40) TSHRHPGDKDM4ELMNAMEN1
SCHEMBL29299850 0.85 HPGD (0.40) TSHRHPGDKDM4ELMNAMEN1

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-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed