SCHEMBL18831775

SCHEMBL18831775

Cc1cc(O)ccc1OCc1c(Br)cccc1N(N)C(=O)N(C)N

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.38
MRGPRX4 Q96LA9 6/20 0.34
POLB P06746 3/20 0.34
LMNA P02545 2/20 0.34
ALDH1A1 P00352 1/20 0.34
PPARA Q07869 2/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
GRM4 Q14833 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL18831565 0.90 SLC22A12 (0.39) FFAR4MRGPRX4PPARASLC22A12
SCHEMBL20686756 0.88 PTGER1 (0.32) FFAR4LMNAALDH1A1MEN1MAPK1
SCHEMBL18831569 0.87 SLC22A12 (0.37) FFAR4LMNAALDH1A1MEN1MAPK1
SCHEMBL21317952 0.87 CD274 (0.36) FFAR4MRGPRX4SLC22A12
SCHEMBL18831638 0.87 MRGPRX4 (0.39) FFAR4MRGPRX4POLBESR1ESR2
SCHEMBL18831518 0.86 ALDH1A1 (0.38) FFAR4MRGPRX4POLBLMNAALDH1A1
SCHEMBL18831366 0.85 SLC22A12 (0.33) FFAR4MRGPRX4SLC22A12
SCHEMBL20686669 0.85 MAPT (0.36) FFAR4MRGPRX4POLBLMNAPPARA
SCHEMBL18831655 0.85 SLC22A12 (0.40) MRGPRX4POLBLMNAALDH1A1PPARA
SCHEMBL20686783 0.85 PTGDR2 (0.37) MRGPRX4LMNAMEN1MAPK1KMT2A

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-2900655-B1 TETRAZOLINONE COMPOUNDS AND THEIR USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2017-05-10 EP disclosed