SCHEMBL13348235

SCHEMBL13348235

O=CCCc1ccc(COc2cccc3c2N(CC2CC2)CCC3)cc1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.47
RXRB P28702 6/20 0.47
RXRG P48443 5/20 0.47
HRH3 Q9Y5N1 1/20 0.36
PREP P48147 3/20 0.34
MRGPRX4 Q96LA9 1/20 0.33
PARP1 P09874 1/20 0.33
KDM1A O60341 1/20 0.32
FFAR1 O14842 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
PTGER4 P35408 1/20 0.32
PTGER2 P43116 1/20 0.32
HTR6 P50406 2/20 0.32

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
SCHEMBL13348157 0.90 RXRA (0.48) RXRARXRBRXRGHRH3MRGPRX4
SCHEMBL13312168 0.87 RXRB (0.64) RXRARXRBRXRGMRGPRX4FFAR1
SCHEMBL13348236 0.87 RXRB (0.49) RXRARXRBRXRGMRGPRX4FFAR1
SCHEMBL13348265 0.87 RXRA (0.47) RXRARXRBRXRGHRH3MRGPRX4
SCHEMBL13348381 0.86 RXRB (0.49) RXRARXRBRXRGHRH3MRGPRX4
SCHEMBL13348037 0.86 RXRA (0.47) RXRARXRBRXRGHRH3PREP
SCHEMBL13348054 0.86 RXRA (0.47) RXRARXRBRXRGHRH3PREP
SCHEMBL13348154 0.85 RXRA (0.46) RXRARXRBRXRGHRH3MRGPRX4
SCHEMBL13348116 0.84 RXRG (0.45) RXRARXRBRXRGKDM1AFFAR1
SCHEMBL13348163 0.84 RXRG (0.45) RXRARXRBRXRGHRH3KDM1A

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 RXRA 475/4885RXRB 465/4885RXRG 541/4885

“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.