SCHEMBL20364346

SCHEMBL20364346

Cc1cccc(Cn2cnc(NC(=O)c3ccc4c(c3)CCCN4C(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAS2R8 Q9NYW2 1/20 0.47
KDM4E B2RXH2 1/20 0.41
MPO P05164 1/20 0.40
RIPK1 Q13546 2/20 0.40
MAPT P10636 2/20 0.38
RECQL P46063 1/20 0.38
BRD4 O60885 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 2/20 0.37
HTT P42858 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM1A O60341 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36

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
SCHEMBL20364347 0.84 TAS2R8 (0.49) TAS2R8MAPTRECQLKDM1A
SCHEMBL20364350 0.84 TAS2R8 (0.49) TAS2R8KDM1A
SCHEMBL20364355 0.84 TAS2R8 (0.47) TAS2R8RIPK1MAPTRECQLKDM1A
SCHEMBL20364348 0.79 MAP3K5 (0.41) TAS2R8RIPK1KDM1ACDK5CDK5R1
SCHEMBL20364351 0.79 TAS2R8 (0.42) TAS2R8RIPK1MAPTRECQLSMN1; SMN2
SCHEMBL27305950 0.78 TAS2R8 (0.47) TAS2R8KDM4ERIPK1MAPTNPC1
SCHEMBL20364384 0.77 TAS2R8 (0.53) TAS2R8KDM4ERIPK1MAPTRECQL
SCHEMBL20364352 0.77 MAP3K5 (0.52)
SCHEMBL27305953 0.77 TAS2R8 (0.46) TAS2R8RIPK1RAB9AALDH1A1LMNA
SCHEMBL20364334 0.76 MAP3K5 (0.43) TAS2R8RIPK1MAPTKDM1ACDK5

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-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2018-07-12 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-20180194773-A1 BICYCLIC HETEROCYCLIC AMIDE DERIVATIVE NR0B1, NR2E1, NR0B2 TAS2R8 2479/4885KDM4E 2080/4885MPO 3784/4885

“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.