SCHEMBL20195491

SCHEMBL20195491

Cc1ccc(C)c(OCc2c(C(=O)Cl)cccc2C2CC2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 4/20 0.40
CNR2 P34972 3/20 0.35
CNR1 P21554 1/20 0.35
PDK2 Q15119 2/20 0.34
PDK4 Q16654 2/20 0.34
GABRA1 P14867 1/20 0.34
GABRG2 P18507 1/20 0.34
GABRB3 P28472 1/20 0.34
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
BDKRB1 P46663 1/20 0.34
PDE10A Q9Y233 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
HTR1A P08908 1/20 0.32
HTR1D P28221 1/20 0.32
SLC6A4 P31645 1/20 0.32
KCNH2 Q12809 1/20 0.32
PPARG P37231 1/20 0.32
P2RX7 Q99572 1/20 0.32

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
SCHEMBL20195498 0.85 SSTR4 (0.41) SSTR4CNR2CNR1HTR1ASLC6A4
SCHEMBL20195502 0.84 GABRA5 (0.40) SSTR4PDK2PDK4GABRA5
SCHEMBL20195479 0.82 KMT2A (0.38)
SCHEMBL16384993 0.79 FFAR4 (0.43) SLC22A12HTR1ASLC6A4
SCHEMBL16385182 0.79 SLC22A12 (0.44) SLC22A12PPARG
SCHEMBL20195657 0.79 P2RX7 (0.36) SSTR4CNR2KCNH2P2RX7
SCHEMBL17788242 0.78 SLC22A12 (0.40) PDK2PDK4SLC22A12
SCHEMBL20195658 0.78 ALDH1A1 (0.40) SSTR4PDK2PDK4GABRA1GABRG2
SCHEMBL20195558 0.77 SSTR4 (0.37) SSTR4CNR2CNR1PDK2PDK4
SCHEMBL20195631 0.76 SSTR4 (0.41) SSTR4HTR1ASLC6A4P2RX7

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
EP-3029035-B1 TETRAZOLINONE COMPOUND, AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-05-30 EP disclosed