SCHEMBL3970675

SCHEMBL3970675

O=C(O)CC1CCc2c1cc(-c1ccc3ccccc3c1)c(OC1CCCC1)c2Br

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.41
PPARD Q03181 6/20 0.39
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
PPARA Q07869 8/20 0.37
PTPN1 P18031 1/20 0.36
FABP4 P15090 1/20 0.35
FFAR1 O14842 1/20 0.34
PPARG P37231 5/20 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
SCHEMBL3961775 0.90 FFAR4 (0.41) FFAR4PPARDPPARAFFAR1PPARG
SCHEMBL3962231 0.89 FFAR4 (0.43) FFAR4PPARDPPARAFABP4PPARG
SCHEMBL3962612 0.88 CYP11B1 (0.42) FFAR4THRATHRBFABP4
SCHEMBL3966733 0.80 PPARD (0.48) FFAR4PPARDPPARAFFAR1PPARG
SCHEMBL4192187 0.80 CYP11B1 (0.43) FFAR4FABP4
SCHEMBL3965826 0.78 PPARD (0.43) FFAR4PPARDPPARAFFAR1PPARG
SCHEMBL3970524 0.78 PPARD (0.43) FFAR4PPARDPPARAFFAR1PPARG
SCHEMBL3965823 0.78 PPARD (0.43) FFAR4PPARDPPARAFFAR1PPARG
SCHEMBL3970781 0.78 CYP11B1 (0.44) FFAR4FABP4
SCHEMBL3961619 0.77 PPARD (0.42) FFAR4PPARDPPARAFFAR1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2006271-A9 SUBSTITUTED BICYCLIC CYCLIC DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2009-07-29 EP disclosed
US-20090054401-A1 Substituted bicyclic derivatives and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-02-26 US disclosed
EP-2006271-A2 SUBSTITUTED BICYCLIC CYCLIC DERIVATIVE AND USE THEREOF Asahi Kasei Pharma Corporation (JP) 2008-12-24 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-20090054401-A1 Substituted bicyclic derivatives and use thereof LTB4R2, LTC4S, LTB4R FFAR4 237/4885PPARD 88/4885THRA 1595/4885

“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.