SCHEMBL13802435

SCHEMBL13802435

O=C(O)Cc1c(-c2ccccc2)n(Cc2ccc(C(F)(F)F)cc2)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.53
AKR1B10 O60218 1/20 0.52
AKR1B1 P15121 1/20 0.52
ABCB1 P08183 1/20 0.48
CFTR P13569 1/20 0.45
FOLH1 Q04609 1/20 0.45
FABP4 P15090 2/20 0.44
PLA2G2A P14555 1/20 0.44
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
PPARG P37231 1/20 0.42
TBXA2R P21731 1/20 0.42
PTGDR Q13258 1/20 0.42

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
SCHEMBL4200412 0.85 PTGDR2 (0.69) PTGDR2PLA2G2ATHRATHRB
SCHEMBL9584600 0.80 PTGDR2 (0.50) PTGDR2AKR1B10AKR1B1FOLH1FABP4
SCHEMBL13802264 0.74 PTGDR2 (0.60) PTGDR2FOLH1PLA2G2ATHRATHRB
SCHEMBL8175838 0.74 PTGER4 (0.47) PTGDR2FOLH1THRATHRBPPARG
SCHEMBL27749337 0.73 PTGES (0.59) PTGDR2ABCB1PLA2G2APPARG
SCHEMBL4210031 0.73 THRA (0.60) PTGDR2FOLH1PLA2G2ATHRATHRB
SCHEMBL9584151 0.73 FOLH1 (0.46) PTGDR2FOLH1PLA2G2ATHRATHRB
SCHEMBL3853784 0.73 PLA2G2A (0.53) PTGDR2PLA2G2ATHRATHRBPPARG
SCHEMBL3853782 0.73 PLA2G2A (0.53) PTGDR2PLA2G2ATHRATHRBPPARG
SCHEMBL8174537 0.72 PTGDR2 (0.52) PTGDR2ABCB1FOLH1PLA2G2ATHRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 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 (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-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD APP, PSEN2, PSEN1 PTGDR2 2287/4885AKR1B10 890/4885AKR1B1 914/4885

“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.