SCHEMBL1708381

SCHEMBL1708381

CCc1nc2ccc(F)cc2n1-c1cccc(CO)c1C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BMI1 P35226 3/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
RAB9A P51151 1/20 0.38
CYP11B1 P15538 3/20 0.37
CYP11B2 P19099 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
AGTR1 P30556 1/20 0.35
AGTR2 P50052 1/20 0.35
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL1707991 0.84 PDE10A (0.40) CYP11B1CYP11B2TSHR
SCHEMBL1708373 0.81 BMI1 (0.40) BMI1RAB9ACYP11B1CYP11B2L3MBTL1
SCHEMBL1708054 0.79 ALDH1A1 (0.48) BMI1RAB9ACYP11B2L3MBTL1TSHR
SCHEMBL1708353 0.75 L3MBTL1 (0.38) L3MBTL1TSHR
SCHEMBL10816256 0.74 PDE10A (0.54) BMI1MEN1KMT2ARAB9ACYP11B1
SCHEMBL1708275 0.73 BMI1 (0.37) BMI1CYP11B1CYP11B2L3MBTL1TSHR
SCHEMBL12473083 0.72 BMI1 (0.47) BMI1RAB9ACYP11B1CYP11B2AGTR1
SCHEMBL10291339 0.72 BMI1 (0.34) BMI1CYP11B2
SCHEMBL1624246 0.71 AGTR1 (0.43) BMI1MEN1KMT2ARAB9ACYP11B1
SCHEMBL1708065 0.70 TSHR (0.59) RAB9AL3MBTL1LMNATSHRHTT

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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-05 US disclosed
EP-2440541-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2012-04-18 EP disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF GPR119, INSR, GLP1R BMI1 2098/4885MEN1 1867/4885KMT2A 4170/4885

“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.