SCHEMBL10172147

SCHEMBL10172147

CCc1cnc(N2CCC(n3cc(F)c4c(Nc5ccc(C(=O)N(C)CCO)cc5C(F)(F)F)ncnc43)CC2)nc1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.40
BRAF P15056 9/20 0.37
LRRK2 Q5S007 2/20 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
SCHEMBL357883 0.93 GPR119 (0.44) GPR119
SCHEMBL10172699 0.91 GPR119 (0.40) GPR119
Hydrochloric Acid SCHEMBL356602 0.89 GPR119 (0.42) GPR119BRAF
SCHEMBL354997 0.89 GPR119 (0.43) GPR119
SCHEMBL10172693 0.88 GPR119 (0.41) GPR119BRAF
SCHEMBL10171879 0.87 GPR119 (0.51) GPR119BRAF
SCHEMBL10172165 0.87 GPR119 (0.42) GPR119
SCHEMBL10172689 0.86 GPR119 (0.44) GPR119
SCHEMBL10172692 0.86 GPR119 (0.41) GPR119BRAF
SCHEMBL10172634 0.86 GPR119 (0.40) GPR119LRRK2

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-20120016119-A1 NOVEL PYRROLO(2,3-d)PYRIMIDINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-01-19 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-20120016119-A1 NOVEL PYRROLO(2,3-d)PYRIMIDINE COMPOUND GPR119, GPR139, HCAR1 GPR119 1/4885BRAF 2824/4885LRRK2 2211/4885

“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.