SCHEMBL13844697

SCHEMBL13844697

Cc1ccc(CCN2C(=O)CCCN2CCC(C)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER2 P43116 17/20 0.56
PTGER4 P35408 16/20 0.56
HRH3 Q9Y5N1 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
CYP2C19 P33261 1/20 0.39

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
SCHEMBL13844700 0.93 PTGER2 (0.49) PTGER2PTGER4HRH3
SCHEMBL13844706 0.88 PTGER2 (0.50) PTGER2PTGER4HRH3SMN1; SMN2CYP2C19
SCHEMBL13844753 0.86 PTGER4 (0.52) PTGER2PTGER4HRH3
SCHEMBL13844764 0.83 NPC1 (0.46) PTGER2PTGER4SMN1; SMN2CYP2C19
SCHEMBL13844763 0.82 ALDH1A1 (0.43) PTGER2PTGER4HRH3SMN1; SMN2
SCHEMBL13844707 0.82 PTGER2 (0.45) PTGER2PTGER4CYP2C19
SCHEMBL13844792 0.81 PTGER2 (0.51) PTGER2PTGER4HRH3
SCHEMBL14113063 0.80 PTGER2 (0.79) PTGER2PTGER4HRH3SMN1; SMN2
SCHEMBL13844777 0.80 PTGER2 (0.43) PTGER2PTGER4
SCHEMBL13844762 0.79 PTGER4 (0.46) PTGER2PTGER4HRH3

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-7531533-B2 6-Membered heterocyclic compound and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2009-05-12 US disclosed
US-20070060590-A1 6-Membered heterocyclic compound and use thereof ASAHI KASEI PHARMA CORPORATION (JP) 2007-03-15 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-20070060590-A1 6-Membered heterocyclic compound and use thereof WNT1, CYP11B2, CYP11B1 PTGER2 39/4885PTGER4 33/4885HRH3 864/4885

“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.