SCHEMBL13802436

SCHEMBL13802436

Cc1c(CC(=O)O)c2ccccc2n1CC1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 5/20 0.55
PTGDR2 Q9Y5Y4 4/20 0.52
CNR1 P21554 3/20 0.49
CNR2 P34972 2/20 0.49
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPC1 O15118 1/20 0.48
ABCB1 P08183 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
EGFR P00533 1/20 0.44
PLA2G1B P04054 1/20 0.44

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
SCHEMBL13802434 0.96 PTGDR2 (0.53) PLA2G2APTGDR2CNR1CNR2THRA
SCHEMBL13802426 0.94 PTGDR2 (0.55) PLA2G2APTGDR2THRATHRBABCB1
SCHEMBL7952544 0.82 PLA2G2A (0.82) PLA2G2APTGDR2KDM4EABCB1PTGS1
SCHEMBL18294853 0.79 PLA2G2A (0.50) PLA2G2ACNR1CNR2NPC1
SCHEMBL18294880 0.78 PLA2G2A (0.48) PLA2G2ACNR1CNR2NPC1
SCHEMBL13802385 0.78 ABCB1 (0.55) PLA2G2APTGDR2KDM4ESMN1; SMN2ABCB1
SCHEMBL18294883 0.76 PTGER4 (0.47) PLA2G2ACNR2NPC1
SCHEMBL13802437 0.76 ABCB1 (0.56) PLA2G2APTGDR2ABCB1PTGS1PTGS2
SCHEMBL7140681 0.74 NPC1 (0.53) CNR1CNR2KDM4ENPC1
SCHEMBL18294839 0.74 PLA2G2A (0.45) PLA2G2APTGDR2CNR1CNR2NPC1

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 PLA2G2A 409/4885PTGDR2 2287/4885CNR1 327/4885

“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.