SCHEMBL18685451

SCHEMBL18685451

Cc1ccc(C(N)C2CN(C(=O)OC(C)(C)C)C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.48
KMT2A Q03164 2/20 0.44
MMP13 P45452 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TP53 P04637 1/20 0.40
DPP4 P27487 1/20 0.40
NR1H2 P55055 1/20 0.40
MC4R P32245 1/20 0.39
NAMPT P43490 1/20 0.39
RORC P51449 1/20 0.39
IDO1 P14902 1/20 0.39
MEN1 O00255 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL18685276 1.00 GPR119 (0.48) GPR119KMT2AMMP13NPC1ALDH1A1
SCHEMBL16232117 0.88 HDAC2 (0.47) GPR119KMT2AMMP13NPC1ALDH1A1
SCHEMBL29977752 0.88 HDAC2 (0.47) GPR119KMT2AMMP13NPC1ALDH1A1
SCHEMBL18685277 0.84 GPR119 (0.34) GPR119KMT2AMMP13NPC1ALDH1A1
SCHEMBL16225169 0.84 ALDH1A1 (0.39) NPC1ALDH1A1MAPTMAPK1HTT
SCHEMBL16232130 0.84 ALDH1A1 (0.39) NPC1ALDH1A1MAPTMAPK1HTT
SCHEMBL16232129 0.84 ALDH1A1 (0.39) NPC1ALDH1A1MAPTMAPK1HTT
SCHEMBL16225250 0.84 LIPE (0.52) GPR119NPC1ALDH1A1MAPTMAPK1
SCHEMBL21848082 0.78 GPR119 (0.53) GPR119MMP13NPC1ALDH1A1MAPT
SCHEMBL16225130 0.77 ESR2 (0.44) GPR119KMT2ANPC1ALDH1A1MAPT

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-9914702-B2 Amine derivatives as potassium channel blockers BIONOMICS LIMITED (AU) 2018-03-13 US disclosed
US-20170088519-A1 AMINE DERIVATIVES AS POTASSIUM CHANNEL BLOCKERS BIONOMICS, LTD (AU) 2017-03-30 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-20170088519-A1 AMINE DERIVATIVES AS POTASSIUM CHANNEL BLOCKERS KCNA3, KCNH3, KCNK3 GPR119 1578/4885KMT2A 288/4885MMP13 4031/4885

“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.