SCHEMBL17677461

SCHEMBL17677461

CCOc1c(C=O)c(-c2ccc(OCc3ccccc3N3NNN(C)C3=O)c(C)c2)nn1C

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.34
MEN1 O00255 2/20 0.34
CYP1A2 P05177 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP2C19 P33261 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
P2RX3 P56373 1/20 0.32
PSD A5PKW4 1/20 0.32
POLB P06746 1/20 0.31

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
SCHEMBL17677486 0.84 SMN1; SMN2 (0.33) HPGDMEN1KMT2AKDM4EALDH1A1
SCHEMBL16273662 0.83 HPGD (0.36) HPGDMEN1CYP1A2KMT2AMAPT
SCHEMBL18831331 0.79 CYP1A2 (0.32) CYP1A2CYP2C19CYP2C9
SCHEMBL16273663 0.78 MAPT (0.36) HPGDMEN1CYP1A2KMT2AMAPT
SCHEMBL17600113 0.77 KDM4E (0.34) HPGDMEN1CYP1A2KMT2AMAPT
SCHEMBL16910708 0.74 MEN1 (0.34) HPGDMEN1CYP1A2KMT2AMAPT
SCHEMBL16910940 0.72 SENP2 (0.38) HPGDMEN1CYP1A2KMT2AMAPT
SCHEMBL16273737 0.72 HPGD (0.36) HPGDMEN1CYP1A2KMT2AMAPT
SCHEMBL16273669 0.72 FFAR1 (0.32) HPGDMEN1CYP1A2KMT2AMAPT
SCHEMBL18831451 0.71 NR1H4 (0.32) RXFP1

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-3006440-A1 TETRAZOLINONE COMPOUND AND APPLICATION OF SAME Sumitomo Chemical Company Limited (JP) 2016-04-13 EP disclosed