SCHEMBL25326418

SCHEMBL25326418

COc1ccc(Cn2nccc2NC(C)=CC(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
NPBWR1 P48145 5/20 0.43
BTK Q06187 1/20 0.42
UCHL1 P09936 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
AKR1C3 P42330 2/20 0.41
ALOX15 P16050 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
ERCC5 P28715 1/20 0.40
FEN1 P39748 1/20 0.40
MCHR1 Q99705 1/20 0.40
NOD2 Q9HC29 1/20 0.40
CACNA1G O43497 1/20 0.39
CACNA1H O95180 1/20 0.39
CACNA1I Q9P0X4 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL25324228 1.00 ALDH1A1 (0.46) ALDH1A1NPBWR1BTKUCHL1NPC1
SCHEMBL29065507 0.87 UCHL1 (0.46) NPBWR1BTKUCHL1NPC1MAPT
SCHEMBL1491135 0.81 NPBWR1 (0.44) ALDH1A1NPBWR1BTKUCHL1ALOX15
SCHEMBL3743887 0.79 BTK (0.44) ALDH1A1NPBWR1BTKUCHL1AKR1C3
SCHEMBL12604335 0.78 UCHL1 (0.46) NPBWR1BTKUCHL1MAPTRAB9A
SCHEMBL12166153 0.77 NPBWR1 (0.48) NPBWR1BTKUCHL1ALOX15L3MBTL1
SCHEMBL13167916 0.76 NPBWR1 (0.49) ALDH1A1NPBWR1BTKUCHL1MAPT
SCHEMBL8076193 0.76 NPBWR1 (0.49) ALDH1A1NPBWR1BTKUCHL1MAPT
SCHEMBL2456576 0.74 NPBWR1 (0.53) NPBWR1UCHL1MCHR1
Hydrochloric Acid SCHEMBL31463493 0.74 NPBWR1 (0.47) ALDH1A1NPBWR1BTKUCHL1MAPT

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-20230339900-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2023-10-26 US disclosed
EP-4214199-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN Pharmaceutica NV (BE) 2023-07-26 EP 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-20230339900-A1 CASEIN KINASE 1 DELTA MODULATORS CSNK1D, CSNK1A1, CSNK2A1 ALDH1A1 1600/4885NPBWR1 1382/4885BTK 1576/4885

“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.