SCHEMBL20195498

SCHEMBL20195498

Cc1cccnc1OCc1c(C(=O)Cl)cccc1C1CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 12/20 0.41
HTR1A P08908 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SSTR1 P30872 7/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
IDO1 P14902 1/20 0.37

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
SCHEMBL20195491 0.85 SSTR4 (0.40) SSTR4HTR1ASLC6A4CNR1CNR2
SCHEMBL20195631 0.84 SSTR4 (0.41) SSTR4HTR1ASLC6A2SLC6A4
SCHEMBL20195627 0.82 ALDH1A1 (0.48) ALDH1A1POLB
SCHEMBL20195656 0.81 L3MBTL1 (0.50) ALDH1A1CNR1CNR2
SCHEMBL17788242 0.79 SLC22A12 (0.40) ALDH1A1
SCHEMBL20195552 0.79 ALDH1A1 (0.43) ALDH1A1POLB
SCHEMBL20195502 0.78 GABRA5 (0.40) SSTR4
SCHEMBL17788255 0.77 NR1H4 (0.41) ALDH1A1
SCHEMBL16385182 0.77 SLC22A12 (0.44) ALDH1A1POLB
SCHEMBL17788243 0.77 MRGPRX4 (0.46) ALDH1A1POLB

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