SCHEMBL15085529

SCHEMBL15085529

O=C(NCC1CC1)c1cc(Cl)ccc1NC(=O)C1CC(c2cc(S(=O)(=O)O)ccn2)=NN1c1ncccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.38
CNR2 P34972 3/20 0.38
CNR1 P21554 1/20 0.38
MALT1 Q9UDY8 1/20 0.36
CHRM1 P11229 3/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
TRPV1 Q8NER1 2/20 0.34
SLC6A9 P48067 1/20 0.34
F10 P00742 2/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CHRM2 P08172 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
SCHEMBL15085550 0.89 P2RX7 (0.37) P2RX7MALT1CHRM1SMN1; SMN2LMNA
SCHEMBL15085598 0.89 MALT1 (0.38) P2RX7MALT1CHRM1HTTSMN1; SMN2
SCHEMBL15085546 0.88 P2RX7 (0.40) P2RX7CNR2CNR1MALT1CHRM1
SCHEMBL15085548 0.87 CNR2 (0.38) P2RX7CNR2CNR1MALT1CHRM1
SCHEMBL15085600 0.86 F10 (0.37) MALT1HTTTRPV1F10POLB
SCHEMBL15189809 0.85 CNR2 (0.42) P2RX7CNR2CNR1MALT1CHRM1
SCHEMBL590527 0.84 CNR2 (0.43) P2RX7CNR2CNR1MALT1CHRM1
SCHEMBL591382 0.83 CNR2 (0.45) P2RX7CNR2CNR1MALT1CHRM1
SCHEMBL15085566 0.83 F10 (0.37) P2RX7CNR2CNR1MALT1CHRM1
SCHEMBL15085578 0.83 CNR2 (0.35) P2RX7CNR2CNR1MALT1HTT

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
US-8481744-B2 Process for producing anthranilamide compound ISHIHARA SANGYO KAISHA, LTD. (JP) 2013-07-09 US disclosed