Sugi Predict

Sugi Predict / Compounds / Cyclopropane

Cyclopropane

Cyclopropane

SCHEMBL17387643

C1CC1.CCN(Cc1cc(C(F)(F)F)ccc1-c1cc(Cc2nn[nH]n2)ccc1OC)C(=O)O

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 15/20 0.58
▸ TBXA2R P21731 4/20 0.58
▸ PTGDR Q13258 4/20 0.58
▸ CETP P11597 5/20 0.54
▸ CYP3A4 P08684 2/20 0.53
▸ CYP2C9 P11712 2/20 0.53
▸ PTGIR P43119 2/20 0.53

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
SCHEMBL155446 0.89 PTGDR2 (0.71) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL153733 0.87 PTGDR2 (0.73) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL138189 0.78 PTGDR2 (0.55) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL137556 0.76 PTGDR2 (0.59) PTGDR2TBXA2RPTGDRCYP3A4CYP2C9
SCHEMBL3556005 0.76 CETP (0.85) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL148348 0.75 PTGDR2 (0.82) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL13746086 0.75 PTGDR2 (0.84) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL137761 0.74 PTGDR2 (0.84) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL137687 0.74 PTGDR2 (0.79) PTGDR2TBXA2RPTGDRCETPCYP3A4
SCHEMBL139117 0.74 PTGDR2 (0.82) PTGDR2TBXA2RPTGDRCETPCYP3A4

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
EP-2257524-B1 N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS BRICKELL BIOTECH INC (US) 2016-01-06 — — EP claimed