SCHEMBL18504485

SCHEMBL18504485

COc1cccc(C(=O)Cl)c1COc1ccn(O)n1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
LMNA P02545 2/20 0.33
ATP4A P20648 1/20 0.33
ATP4B P51164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AKR1C3 P42330 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
JAK2 O60674 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
NR1H4 Q96RI1 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
SCHEMBL18504683 0.89 KDM4E (0.38) L3MBTL1RAB9ALMNASMN1; SMN2MAPT
SCHEMBL18504650 0.89 HTT (0.40) RAB9ANPC1SMN1; SMN2HTTNR1H4
SCHEMBL18504747 0.88 NPC1 (0.36) CTSDL3MBTL1RAB9ANPC1LMNA
SCHEMBL20845023 0.88 NPC1 (0.38) CTSDL3MBTL1RAB9ANPC1LMNA
SCHEMBL18504554 0.88 LMNA (0.40) CTSDRAB9ANPC1LMNASMN1; SMN2
SCHEMBL18504188 0.88 MAPT (0.40) CTSDRAB9ANPC1LMNASMN1; SMN2
SCHEMBL18504750 0.87 NPC1 (0.37) CTSDL3MBTL1RAB9ANPC1LMNA
SCHEMBL18504496 0.87 IRAK4 (0.36) LMNANR1H4
SCHEMBL22564338 0.87 CTSD (0.35) CTSDL3MBTL1RAB9ANPC1LMNA
SCHEMBL18504730 0.87 NR1H4 (0.30) NR1H4

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