SCHEMBL3451544

SCHEMBL3451544

Cc1nn(-c2ccc(C(F)(F)F)cn2)cc1COc1ccc2c(c1)CC[C@@H](CC(=O)O)C2

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 2/20 0.46
ITGA2B P08514 2/20 0.46
FFAR1 O14842 6/20 0.44
PPARD Q03181 5/20 0.42
PPARA Q07869 4/20 0.42
PPARG P37231 2/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
S1PR1 P21453 2/20 0.35
FFAR4 Q5NUL3 1/20 0.34
DGAT1 O75907 3/20 0.34
KCNH2 Q12809 2/20 0.34
ADORA2A P29274 1/20 0.34
MCHR1 Q99705 1/20 0.34

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
SCHEMBL6034690 0.79 PPARD (0.48) FFAR1PPARDPPARAPPARGHPGD
SCHEMBL6035888 0.77 PPARD (0.55) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL6036002 0.76 NR1H2 (0.45) PPARDPPARAPPARGSMN1; SMN2DGAT1
SCHEMBL6035082 0.76 PPARD (0.52) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL6036359 0.76 FFAR1 (0.47) FFAR1PPARDPPARAPPARGFFAR4
SCHEMBL6035594 0.75 FFAR1 (0.45) FFAR1PPARDPPARAPPARGHPGD
SCHEMBL6218738 0.74 SMN1; SMN2 (0.44) HPGDSMN1; SMN2MCHR1
SCHEMBL6035033 0.74 PPARA (0.52) PPARDPPARAPPARGHPGDSMN1; SMN2
SCHEMBL6035801 0.73 PPARD (0.45) PPARDPPARAPPARGHPGDSMN1; SMN2
SCHEMBL6035450 0.69 FFAR1 (0.37) FFAR1PPARDPPARAPPARGHPGD

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-7820837-B2 ethyl {6-[(3-phenoxybenzyl)oxy]-3,4-dihydronaphthalen-1-yl}acetate; having a GPR40 receptor function modulating action and being useful as an insulin secretagogue or a pharmaceutical agent for the prophylaxis or treatment of diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-7820837-B2 ethyl {6-[(3-phenoxybenzyl)oxy]-3,4-dihydronaphthalen-1-yl}acetate; having a GPR40 receptor function modulating action and being useful as an insulin secretagogue or a pharmaceutical agent for the prophylaxis or treatment of diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-7820837-B2 ethyl {6-[(3-phenoxybenzyl)oxy]-3,4-dihydronaphthalen-1-yl}acetate; having a GPR40 receptor function modulating action and being useful as an insulin secretagogue or a pharmaceutical agent for the prophylaxis or treatment of diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-20060258722-A1 Condensed ring compound TAKEDA PHARMACEUTICAL COMPANY., LTD. (JP) 2006-11-16 US disclosed
EP-1630152-A1 CONDENSED RING COMPOUND Takeda Pharmaceutical Company Limited (JP) 2006-03-01 EP 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-20060258722-A1 Condensed ring compound GPR119, GLP1R, GCGR ITGB3 4010/4885ITGA2B 3725/4885FFAR1 93/4885

“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.