SCHEMBL31389644

SCHEMBL31389644

CC1CCc2cc(C(=O)O)nn2C1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.37
RIPK1 Q13546 4/20 0.36
ESR1 P03372 1/20 0.36
HCAR2 Q8TDS4 2/20 0.35
ALDH1A1 P00352 3/20 0.34
TSHR P16473 1/20 0.34
GAA P10253 1/20 0.33
RECQL P46063 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PLAT P00750 1/20 0.32
PDK1 Q15118 1/20 0.31
PDK2 Q15119 1/20 0.31
PLA2G1B P04054 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
HPGD P15428 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
SCHEMBL31389606 0.80 KMT2A (0.44) POLBALDH1A1TSHRGAAKMT2A
SCHEMBL4910441 0.75 USP2 (0.43) POLBRIPK1ESR1HCAR2ALDH1A1
SCHEMBL6383954 0.75 USP2 (0.43) POLBRIPK1ESR1HCAR2ALDH1A1
SCHEMBL31389638 0.73
SCHEMBL1423651 0.70 HTR2A (0.44)
SCHEMBL31389779 0.68 RIPK1 (0.47) POLBRIPK1ESR1HCAR2TSHR
SCHEMBL27627731 0.68 APOBEC3A (0.32) POLBHCAR2
SCHEMBL23779041 0.66 GRM5 (0.39) POLBMEN1KMT2A
SCHEMBL21033178 0.66 RIPK1 (0.37) RIPK1ALDH1A1GAARECQLMEN1
SCHEMBL22887696 0.66 RIPK1 (0.47) RIPK1ALDH1A1GAARECQLMEN1

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-2025043225-A2 DEGRADERS OF CYCLIN-DEPENDENT KINASE 2 GENENTECH, INC. (US) 2025-02-27 WO disclosed