SCHEMBL3295196

SCHEMBL3295196

O=C(Nc1ccc(F)c(F)c1)N1CCc2nc(NCc3ccc(F)cc3)n(-c3ccccc3)c(=O)c2C1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRLHR P49683 5/20 0.43
CLPP Q16740 3/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 1/20 0.40
PDE10A Q9Y233 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
FAAH O00519 1/20 0.38
TRPV1 Q8NER1 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
NAMPT P43490 1/20 0.37

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
SCHEMBL3296928 0.96 CLPP (0.43) PRLHRCLPPPDE10ANAMPT
SCHEMBL3296703 0.94 PRLHR (0.49) PRLHRCLPPMEN1KMT2A
SCHEMBL3302814 0.94 PRLHR (0.43) PRLHRCLPPNPC1RAB9ANAMPT
SCHEMBL3297401 0.92 CLPP (0.41) PRLHRCLPPPDE10AFAAHTRPV1
SCHEMBL3298474 0.92 PRLHR (0.45) PRLHRCLPPNPC1RAB9APDE10A
SCHEMBL3297673 0.90 PRLHR (0.45) PRLHRNPC1RAB9AMEN1KMT2A
SCHEMBL3295357 0.90 CACNA1H (0.43) PRLHRCLPPNPC1RAB9AFAAH
SCHEMBL3298747 0.90 CLPP (0.40) PRLHRCLPPPDE10APTGDR2NAMPT
SCHEMBL3303714 0.89 CLPP (0.40) PRLHRCLPPPDE10A
SCHEMBL3298232 0.89 NAMPT (0.40) PRLHRCLPPNAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232282-B2 Compound having bicyclic pyrimidine structure and pharmaceutical composition comprising the same DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-07-31 US disclosed
US-20100093771-A1 Compound having bicyclic pyrimidine structure and pharmaceutical composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-15 US disclosed
EP-2078719-A1 COMPOUND HAVING BICYCLIC PYRIMIDINE STRUCTURE AND PHARMACEUTICAL COMPOSITION COMPRISING THE COMPOUND Dainippon Sumitomo Pharma Co., Ltd. (JP) 2009-07-15 EP 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-20100093771-A1 Compound having bicyclic pyrimidine structure and pharmaceutical composition comprising the same GART, MGAT2, MGAT1 PRLHR 3093/4885CLPP 4670/4885NPC1 409/4885

“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.