SCHEMBL18504563

SCHEMBL18504563

CCOc1cccc(Cl)c1COc1ccn(O)n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ALOX12 P18054 1/20 0.34
BLM P54132 1/20 0.34
P2RX7 Q99572 1/20 0.34

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
SCHEMBL18504690 0.88 SMN1; SMN2 (0.38) ALDH1A1L3MBTL1POLBLMNASMN1; SMN2
SCHEMBL18504467 0.87 SMN1; SMN2 (0.35) SMN1; SMN2PKMNR1H4MAPT
SCHEMBL18504671 0.86 SMN1; SMN2 (0.46) ALDH1A1LMNASMN1; SMN2PKMNR1H4
SCHEMBL18504697 0.85 NR1H4 (0.38) LMNASMN1; SMN2PKMNR1H4MAPT
SCHEMBL18504341 0.85 DAO (0.33) ALDH1A1L3MBTL1LMNASMN1; SMN2GAA
SCHEMBL18504687 0.85 DAO (0.33) ALDH1A1L3MBTL1POLBLMNAGAA
SCHEMBL22564063 0.85 ALDH1A1 (0.37) ALDH1A1L3MBTL1POLBLMNASMN1; SMN2
SCHEMBL18504557 0.85 ALDH1A1 (0.43) ALDH1A1L3MBTL1POLBSMN1; SMN2PKM
SCHEMBL18504545 0.83 S1PR5 (0.37) SMN1; SMN2PKMNR1H4
SCHEMBL18504683 0.83 KDM4E (0.38) L3MBTL1LMNASMN1; SMN2MAPT

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-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 US disclosed