SCHEMBL9047880

SCHEMBL9047880

COC(=O)c1cc(COCc2cc(C(=O)OC)no2)on1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.58
MAPK1 P28482 5/20 0.49
HSD17B10 Q99714 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
NOTUM Q6P988 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
STAT3 P40763 1/20 0.40
ATM Q13315 1/20 0.40
RAB9A P51151 4/20 0.38
NPC1 O15118 3/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL10644274 0.89 MRGPRX4 (0.58) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL18973243 0.84 MRGPRX4 (0.52) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL18255998 0.84 MRGPRX4 (0.52) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL10641694 0.82 MRGPRX4 (0.51) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL8145313 0.82 MRGPRX4 (0.51) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL5243287 0.82 MRGPRX4 (0.51) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL10644438 0.82 MRGPRX4 (0.55) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL2220207 0.81 MRGPRX4 (0.51) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL20020329 0.81 MRGPRX4 (0.46) MRGPRX4MAPK1HSD17B10SMN1; SMN2MAPT
SCHEMBL14198670 0.80 MRGPRX4 (0.60) MRGPRX4MAPK1HSD17B10SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0555068-B1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1996-04-10 EP disclosed
EP-0555068-A1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP disclosed