SCHEMBL4915749

SCHEMBL4915749

CCOC(=O)Cc1ccccc1Cc1cccc(O)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.44
PKM P14618 1/20 0.44
NLRP3 Q96P20 2/20 0.42
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
AHR P35869 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 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
SCHEMBL14259330 0.86 CYP4F2 (0.59) NLRP3CYP4F2CYP4A11ALDH1A1KDM4E
SCHEMBL4920335 0.84 KEAP1 (0.49) EGFRPKMCYP4F2CYP4A11ALDH1A1
SCHEMBL14259344 0.84 MTNR1A (0.52) ALDH1A1MAPTKDM4EL3MBTL1PPARG
SCHEMBL905142 0.84 CTBP2 (0.49) EGFRPKMALDH1A1MAPK1L3MBTL1
SCHEMBL68340 0.80 PKM (0.60) PKMNLRP3CYP4F2CYP4A11ALDH1A1
SCHEMBL6878047 0.77 PKM (0.57) PKMNLRP3CYP4F2CYP4A11ALDH1A1
SCHEMBL31424953 0.77 PKM (0.57) PKMNLRP3CYP4F2CYP4A11ALDH1A1
SCHEMBL31424955 0.77 PKM (0.57) PKMNLRP3CYP4F2CYP4A11ALDH1A1
SCHEMBL14259334 0.76 TDP1 (0.51) ALDH1A1MAPTKDM4EMEN1LMNA
SCHEMBL10758204 0.76 SMN1; SMN2 (0.46) PKMCYP4F2CYP4A11ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064716-A1 Alpha v beta 3 and/or alpha v beta 5 integrin inhibitors; osteoporosis, retinopathy, tumor metastasis and angiogenesis; decreased side effects, improved potency; 3-(2-(3-[2-(5,6,7,8- Tetrahydro-1,8-naphthyridin-2-yl)ethoxy]benzyl}-phenyl)propionic acid PHARMACIA 2008-03-13 US disclosed
US-20080064716-A1 Alpha v beta 3 and/or alpha v beta 5 integrin inhibitors; osteoporosis, retinopathy, tumor metastasis and angiogenesis; decreased side effects, improved potency; 3-(2-(3-[2-(5,6,7,8- Tetrahydro-1,8-naphthyridin-2-yl)ethoxy]benzyl}-phenyl)propionic acid PHARMACIA 2008-03-13 US disclosed
US-20080064716-A1 Alpha v beta 3 and/or alpha v beta 5 integrin inhibitors; osteoporosis, retinopathy, tumor metastasis and angiogenesis; decreased side effects, improved potency; 3-(2-(3-[2-(5,6,7,8- Tetrahydro-1,8-naphthyridin-2-yl)ethoxy]benzyl}-phenyl)propionic acid PHARMACIA 2008-03-13 US disclosed
EP-1802618-A1 BIPHENYL INTEGRIN ANTAGONISTS Pharmacia Corporation (US) 2007-07-04 EP disclosed
WO-2006043930-A1 BIPHENYL INTEGRIN ANTAGONISTS PHARMACIA CORPORATION (US) 2006-04-27 WO 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 (1 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-20080064716-A1 Alpha v beta 3 and/or alpha v beta 5 integrin inhibitors; osteoporosis, retinopathy, tumor metastasis and angiogenesis; decreased side effects, improved potency; 3-(2-(3-[2-(5,6,7,8- Tetrahydro-1,8-naphthyridin-2-yl)ethoxy]benzyl}-phenyl)propionic acid ITGA5, ITGAV, ITGB5 EGFR 695/4885PKM 2202/4885NLRP3 3759/4885

“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.