SCHEMBL31545239

SCHEMBL31545239

C=CCc1cc(O)c(C(C)C)c(O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.52
TNKS O95271 2/20 0.46
TNKS2 Q9H2K2 1/20 0.46
PARP1 P09874 1/20 0.46
GABRA1 P14867 4/20 0.46
GABRB2 P47870 4/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 2/20 0.46
GAA P10253 2/20 0.46
MAPT P10636 2/20 0.46
CNR1 P21554 2/20 0.46
CNR2 P34972 2/20 0.46
KMT2A Q03164 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH2 P05091 1/20 0.46
AKR1B1 P15121 1/20 0.46
HPGD P15428 1/20 0.46
PPARG P37231 1/20 0.46
PPARD Q03181 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
SCHEMBL2493537 0.76 TNKS (0.63) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL27930396 0.76 AHR (0.44) ALDH1A1MEN1MAPTCNR1KMT2A
SCHEMBL5598779 0.76 GSR (0.53) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL9743445 0.74 TRPA1 (0.48) GABRA1GABRB2ALDH1A1MEN1MAPT
SCHEMBL17969003 0.74 XDH (0.59) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL31518933 0.73 TNKS (0.51) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL31275637 0.72 ALDH1A1 (0.38) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL27781372 0.72 AHR (0.55) GABRA1GABRB2ALDH1A1CNR1PTGS1
SCHEMBL9774970 0.72 ALDH1A1 (0.38) XDHTNKSTNKS2PARP1GABRA1
SCHEMBL31545109 0.72 AHR (0.41) GABRA1GABRB2ALDH1A1MEN1MAPT

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
US-20250090554-A1 A METHOD OF TREATING DEPRESSION BY IMMUNE MODULATION MYND LIFE SCIENCES INC (CA) 2025-03-20 US disclosed