SCHEMBL585512

SCHEMBL585512

Cc1c(F)ccc(CCC(=O)O)c1F

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.48
FFAR1 O14842 14/20 0.47
FFAR4 Q5NUL3 12/20 0.47
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
RXRG P48443 1/20 0.40

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
SCHEMBL29009947 0.91 SMN1; SMN2 (0.43) NPSR1FFAR1FFAR4SMN1; SMN2RXRG
SCHEMBL8796401 0.86 NPSR1 (0.48) NPSR1FFAR1FFAR4POLB
SCHEMBL4717045 0.83 FFAR1 (0.49) NPSR1FFAR1FFAR4POLB
SCHEMBL23655932 0.80 NPSR1 (0.55) NPSR1FFAR1FFAR4POLBRXRG
SCHEMBL23782788 0.79 FFAR1 (0.46) NPSR1FFAR1FFAR4POLB
SCHEMBL1261294 0.79 SMN1; SMN2 (0.54) NPSR1FFAR1FFAR4SMN1; SMN2
SCHEMBL27828902 0.78 POLB (0.53) NPSR1FFAR1FFAR4POLB
SCHEMBL12070041 0.77 POLB (0.51) NPSR1FFAR1FFAR4POLB
SCHEMBL3797596 0.76 FFAR1 (0.47) NPSR1FFAR1FFAR4POLB
SCHEMBL31674242 0.76 FFAR1 (0.47) NPSR1FFAR1FFAR4POLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188082-B2 5,6,7,8-tetrahydro-imidazo[1,5-α]pyrazine derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2012-05-29 US disclosed
EP-2125823-B1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2012-02-15 EP disclosed
US-20100093740-A1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-04-15 US disclosed
EP-2125823-A1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE DERIVATIVES Actelion Pharmaceuticals Ltd. (CH) 2009-12-02 EP disclosed
WO-2008078291-A1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-07-03 WO 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-20100093740-A1 5,6,7,8-TETRAHYDRO-IMIDAZO[1,5-A]PYRAZINE DERIVATIVES HCRTR1, HCRTR2, NPY5R NPSR1 12/4885FFAR1 192/4885FFAR4 191/4885

“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.