SCHEMBL23903284

SCHEMBL23903284

CC(C)Cc1cc(C(C)C)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX12 P18054 2/20 0.37
ALOX15 P16050 1/20 0.37
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
LMNA P02545 1/20 0.36
RNASEH1 O60930 1/20 0.36
PNMT P11086 1/20 0.36
SLC5A1 P13866 1/20 0.36
SLC5A2 P31639 1/20 0.36
TRPA1 O75762 1/20 0.35
PTGS1 P23219 1/20 0.35
CACNA1C Q13936 1/20 0.35
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34
HIF1A Q16665 1/20 0.34
IDO1 P14902 1/20 0.34
SLC6A4 P31645 1/20 0.34
TYR P14679 1/20 0.33

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
SCHEMBL21449131 0.84 ALOX12 (0.37) ALOX12ALOX15GABRA1GABRB2LMNA
SCHEMBL10053122 0.82 L3MBTL1 (0.39) LMNARNASEH1SLC5A1SLC5A2TRPA1
SCHEMBL1437611 0.80 SLC5A1 (0.42) ALOX12LMNARNASEH1SLC5A1SLC5A2
SCHEMBL20946452 0.80 PNMT (0.43) ALOX12LMNAPNMTSLC5A1SLC5A2
SCHEMBL5018843 0.79 SLC6A2 (0.45) ALOX12ALOX15GABRA1GABRB2LMNA
SCHEMBL11810508 0.78 LMNA (0.35) ALOX12GABRA1GABRB2LMNARNASEH1
SCHEMBL10019194 0.78 KCNH2 (0.39) ALOX12ALOX15GABRA1GABRB2PNMT
SCHEMBL7637108 0.78 GABRA1 (0.60) ALOX12ALOX15GABRA1GABRB2LMNA
SCHEMBL12016027 0.77 IDO1 (0.40) LMNASLC5A1SLC5A2TRPA1PTGS1
SCHEMBL10510199 0.77 HTR1D (0.51) ALOX12LMNAPNMTSLC5A1SLC5A2

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-2021203016-A2 PROTEIN-PROTEIN INTERACTION STABILIZERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-10-07 WO disclosed