SCHEMBL10148355

SCHEMBL10148355

O=C(O)[C@H]1CC[C@H](Oc2ccccc2F)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.57
LPAR5 Q9H1C0 1/20 0.57
HTR1A P08908 4/20 0.48
SLC6A2 P23975 4/20 0.48
SLC6A3 Q01959 3/20 0.48
ACSL1 P33121 3/20 0.44
NOTUM Q6P988 1/20 0.43
ACSL3 O95573 1/20 0.43
ACSL6 Q9UKU0 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
HPGD P15428 1/20 0.42
DGAT1 O75907 1/20 0.42
SOAT1 P35610 1/20 0.42
GRIK1 P39086 1/20 0.42
GRIA2 P42262 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
GRIN1 Q05586 1/20 0.41

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
SCHEMBL16506413 1.00 LPAR1 (0.57) LPAR1LPAR5HTR1ASLC6A2SLC6A3
SCHEMBL28011392 0.88 SLC6A2 (0.54) LPAR1LPAR5HTR1ASLC6A2SLC6A3
SCHEMBL29966 0.84 SLC6A2 (0.61) LPAR1LPAR5HTR1ASLC6A2SLC6A3
SCHEMBL2473263 0.83 LPAR1 (0.51) LPAR1LPAR5HTR1ASLC6A2SLC6A3
SCHEMBL2473260 0.83 LPAR1 (0.51) LPAR1LPAR5HTR1ASLC6A2SLC6A3
SCHEMBL2473607 0.82 LPAR1 (0.50) LPAR1LPAR5HTR1ASLC6A2SLC6A3
SCHEMBL2473606 0.82 LPAR1 (0.50) LPAR1LPAR5HTR1ASLC6A2SLC6A3
SCHEMBL16507018 0.81 LPAR1 (0.52) LPAR1LPAR5HPGD
SCHEMBL10148356 0.81 LPAR1 (0.52) LPAR1LPAR5HPGD
SCHEMBL16506986 0.81 PDE4A (0.59) LPAR1LPAR5ACSL1ACSL3ACSL6

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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 US disclosed
US-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND ASTELLAS PHARMA INC. (JP) 2012-02-23 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-20120046292-A1 DIACYLETHYLENEDIAMINE COMPOUND DGAT1, DGAT2, DIMT1 LPAR1 1629/4885LPAR5 2217/4885HTR1A 2176/4885

“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.