SCHEMBL19947465

SCHEMBL19947465

O=C1c2ccccc2C(=O)N1OCCc1cc(-c2ccccc2)ccc1-c1cccc(OCc2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.50
PTGER3 P43115 3/20 0.50
GRM5 P41594 2/20 0.50
GSTP1 P09211 2/20 0.47
MRGPRX4 Q96LA9 2/20 0.44
HDAC4 P56524 1/20 0.41
NAAA Q02083 1/20 0.41
NR4A2 P43354 1/20 0.41
PTGER1 P34995 2/20 0.41
PTGER2 P43116 2/20 0.41
MAOB P27338 1/20 0.41
PRKDC P78527 1/20 0.41
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40

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
SCHEMBL19826550 0.84 GAA (0.43) PTGER4PTGER3PTGER1PTGER2
SCHEMBL19947462 0.81 PTGER4 (0.51) PTGER4PTGER3GSTP1MRGPRX4HDAC4
SCHEMBL18076563 0.79 CYP4F2 (0.59) PTGER4PTGER3GSTP1MRGPRX4HDAC4
SCHEMBL18076580 0.75 PTGER4 (0.61) PTGER4PTGER3GSTP1MRGPRX4HDAC4
SCHEMBL2137838 0.72 MRGPRX4 (0.69) GSTP1MRGPRX4HDAC4NAAANR4A2
SCHEMBL16346074 0.71 GSTP1 (0.66) PTGER4PTGER3GSTP1MRGPRX4HDAC4
SCHEMBL19961835 0.71 MRGPRX4 (0.53) PTGER4PTGER3GSTP1MRGPRX4HDAC4
SCHEMBL379281 0.71 MAOB (0.67) GSTP1MRGPRX4NR4A2MAOBFFAR4
SCHEMBL18076572 0.70 ERN1 (0.61) PTGER4PTGER3GSTP1MRGPRX4HDAC4
SCHEMBL19968490 0.70 PTGER4 (0.52) PTGER4PTGER3MRGPRX4HDAC4NR4A2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3271320-B1 COMPOSITIONS FOR THE TREATMENT OF FIBROSIS AND FIBROSIS-RELATED CONDITIONS VECTUS BIOSYSTEMS LTD (AU) 2019-10-23 EP disclosed
EP-3271320-B1 COMPOSITIONS FOR THE TREATMENT OF FIBROSIS AND FIBROSIS-RELATED CONDITIONS VECTUS BIOSYSTEMS LTD (AU) 2019-10-23 EP disclosed
US-10035775-B2 Compositions for the treatment of fibrosis and fibrosis-related conditions VECTUS BIOSYSTEMS LIMITED (AU) 2018-07-31 US disclosed
US-10035775-B2 Compositions for the treatment of fibrosis and fibrosis-related conditions VECTUS BIOSYSTEMS LIMITED (AU) 2018-07-31 US disclosed
US-20180072682-A1 COMPOSITIONS FOR THE TREATMENT OF FIBROSIS AND FIBROSIS-RELATED CONDITIONS VECTUS BIOSYSTEMS LIMITED (AU) 2018-03-15 US disclosed
US-20180072682-A1 COMPOSITIONS FOR THE TREATMENT OF FIBROSIS AND FIBROSIS-RELATED CONDITIONS VECTUS BIOSYSTEMS LIMITED (AU) 2018-03-15 US disclosed
US-9233938-B2 Inhibitors of cholesterol ester transfer protein CONCERT PHARMACEUTICALS, INC. (US) 2016-01-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10035775-B2 Compositions for the treatment of fibrosis and fibrosis-related conditions MMP1, COL1A1, COL2A1 PTGER4 616/4885PTGER3 644/4885GRM5 4406/4885
US-20180072682-A1 COMPOSITIONS FOR THE TREATMENT OF FIBROSIS AND FIBROSIS-RELATED CONDITIONS MMP1, COL1A1, COL2A1 PTGER4 616/4885PTGER3 644/4885GRM5 4406/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.