SCHEMBL22286151

SCHEMBL22286151

CCn1nc(C)c(C(=O)OCC(=O)c2c(F)cc(F)cc2F)c1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.47
LMNA P02545 7/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
HPGD P15428 3/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A1 P00352 6/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 3/20 0.37
HTT P42858 2/20 0.37
POLB P06746 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 3/20 0.37
ALOX15 P16050 1/20 0.37
HBB P68871 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PDE4D Q08499 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
NPC1 O15118 1/20 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
SCHEMBL20551486 0.90 MAPK1 (0.45) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL22286153 0.88 MAPK1 (0.53) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL20551566 0.85 MAPK1 (0.41) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL20551835 0.84 HPGD (0.47) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL22286135 0.84 KMT2A (0.54) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL22286193 0.83 MAPK1 (0.55) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL20551372 0.81 MAPK1 (0.51) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL20551296 0.81 NPC1 (0.44) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL22286173 0.80 MAPK1 (0.49) MAPK1LMNASMN1; SMN2HPGDKMT2A
SCHEMBL20551881 0.80 MAPK1 (0.51) MAPK1LMNASMN1; SMN2HPGDKMT2A

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-20200247800-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2020-08-06 US disclosed
CN-110914263-A Substituted bicyclic heterocyclic compounds as NADPH oxidase inhibitors 格兰马克药品股份有限公司 2020-03-24 CN 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-20200247800-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS NOX1, CYBB, NOX4 MAPK1 943/4885LMNA 3874/4885SMN1; SMN2 3077/4885

“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.