SCHEMBL13348283

SCHEMBL13348283

COc1ccccc1C(=O)N1CCc2cccc(COc3ccc(CCC=O)c(F)c3)c21

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
PARP10 Q53GL7 3/20 0.44
PARP14 Q460N5 1/20 0.44
PTGER4 P35408 2/20 0.41
PTGER2 P43116 2/20 0.41
PARP15 Q460N3 2/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
MAPK1 P28482 1/20 0.40
RXFP1 Q9HBX9 2/20 0.39
TP53 P04637 1/20 0.39
F2RL3 Q96RI0 1/20 0.37
DRD3 P35462 1/20 0.35

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
SCHEMBL13348407 0.90 FFAR1 (0.38) ALDH1A1PARP10PARP14PTGER4PTGER2
SCHEMBL13312466 0.89 ALDH1A1 (0.46) ALDH1A1PARP10PARP14PTGER4PTGER2
SCHEMBL13348240 0.86 PTGER2 (0.49) ALDH1A1PTGER4PTGER2KMT2AMEN1
SCHEMBL13348170 0.84 PTGER4 (0.39) ALDH1A1PARP10PARP14PTGER4PTGER2
SCHEMBL13348138 0.81 HPD (0.41) ALDH1A1PTGER4PTGER2
SCHEMBL13348415 0.81 TSHR (0.43) ALDH1A1PARP10PARP14PTGER4PTGER2
SCHEMBL13348045 0.80 DRD2 (0.39) ALDH1A1PTGER4PTGER2KMT2AMEN1
SCHEMBL13312474 0.79 FFAR1 (0.51) DRD3
SCHEMBL13312467 0.78 FFAR1 (0.43) PTGER4PTGER2
SCHEMBL13348179 0.77 PTGER4 (0.43) ALDH1A1PTGER4PTGER2

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
US-20100152165-A1 CARBOXYLIC ACID DERIVATIVES ASTELLAS PHARMA INC. (JP) 2010-06-17 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-20100152165-A1 CARBOXYLIC ACID DERIVATIVES GPR119, GPR65, HCAR1 ALDH1A1 1850/4885PARP10 2338/4885PARP14 3772/4885

“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.