SCHEMBL20195429

SCHEMBL20195429

Cc1ccc(-c2ccc(OCc3c(C)cccc3-n3nn[nH]c3=O)nc2C)cc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MGAT2 Q10469 2/20 0.33
MOGAT2 Q3SYC2 2/20 0.33
BRD9 Q9H8M2 1/20 0.31
BRD7 Q9NPI1 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
KCNH2 Q12809 1/20 0.31
DGAT1 O75907 1/20 0.31
FFAR1 O14842 1/20 0.30
PDE10A Q9Y233 1/20 0.30

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
SCHEMBL20195436 0.85 FLT3 (0.33) GABRA5
SCHEMBL20195527 0.85 HCAR2 (0.33) GABRG2GABRB3GABRA5
SCHEMBL17804259 0.83 BRD9 (0.33) BRD9BRD7GABRG2GABRB3GABRA5
SCHEMBL20195449 0.83 ALDH1A1 (0.36) MGAT2MOGAT2BRD9BRD7PDE10A
SCHEMBL20195457 0.81 CA12 (0.34) GABRA5
SCHEMBL17811664 0.80
SCHEMBL17614621 0.79 GABRA5 (0.36) GABRA5KCNH2PDE10A
SCHEMBL22038662 0.79 SLC22A12 (0.45) MGAT2MOGAT2FFAR1
SCHEMBL22038152 0.79 BTK (0.32)
SCHEMBL22037221 0.77 BTK (0.38) MGAT2MOGAT2

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