SCHEMBL9716888

SCHEMBL9716888

CCCCOc1ccccc1C=CC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 1/20 0.62
PTGER4 P35408 1/20 0.62
PTGER3 P43115 1/20 0.62
PTGER2 P43116 1/20 0.62
GAA P10253 2/20 0.58
HTT P42858 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.54
AKR1C3 P42330 1/20 0.52
KDM4E B2RXH2 4/20 0.50
LMNA P02545 3/20 0.50
MAPT P10636 3/20 0.50
NFE2L2 Q16236 2/20 0.50
KMT2A Q03164 2/20 0.50
ATM Q13315 1/20 0.50
AR P10275 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TFEB P19484 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49

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
SCHEMBL5078092 1.00 PTGER1 (0.62) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL5178116 0.95 PTGER1 (0.61) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL242465 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL9716995 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL8092292 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL9402733 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL4331862 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL4331860 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL9716933 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA
SCHEMBL9717006 0.94 PTGER1 (0.59) PTGER1PTGER4PTGER3PTGER2GAA

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
WO-1992009561-A1 NEW AMIDE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-06-11 WO disclosed