SCHEMBL19834263

SCHEMBL19834263

Nc1ccc2c(c1)C(=O)N(CC1CO1)C2=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.72
CASP1 P29466 5/20 0.72
HSD17B10 Q99714 4/20 0.72
CASP7 P55210 3/20 0.72
NPC1 O15118 4/20 0.55
RAB9A P51151 4/20 0.55
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ANPEP P15144 2/20 0.44
DPP4 P27487 1/20 0.44
ACHE P22303 1/20 0.43
TSHR P16473 3/20 0.43
MAPK1 P28482 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RPS6KA2 Q15349 1/20 0.43
DDB1 Q16531 1/20 0.42

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
SCHEMBL19834295 0.81 ALDH1A1 (0.50) ALDH1A1CASP1HSD17B10CASP7NPC1
SCHEMBL959122 0.81 ALDH1A1 (0.50) ALDH1A1CASP1HSD17B10CASP7NPC1
SCHEMBL15919819 0.81 ALDH1A1 (0.50) ALDH1A1CASP1HSD17B10CASP7NPC1
SCHEMBL959179 0.81 ALDH1A1 (0.50) ALDH1A1CASP1HSD17B10CASP7NPC1
SCHEMBL4093992 0.81 ALDH1A1 (0.63) ALDH1A1CASP1HSD17B10CASP7NPC1
SCHEMBL15906663 0.80 ALDH1A1 (0.64) ALDH1A1CASP1HSD17B10CASP7NPC1
SCHEMBL29402853 0.80 CYP2C9 (0.68) ALDH1A1CASP1HSD17B10CASP7MEN1
SCHEMBL38819 0.80 CYP2C9 (0.68) ALDH1A1CASP1HSD17B10CASP7MEN1
SCHEMBL29567211 0.80 CYP2C9 (0.68) ALDH1A1CASP1HSD17B10CASP7MEN1
SCHEMBL29570568 0.80 CYP2C9 (0.68) ALDH1A1CASP1HSD17B10CASP7MEN1

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-20180358655-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2018-12-13 US disclosed
EP-3279995-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE Sumitomo Seika Chemicals CO. LTD. (JP) 2018-02-07 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-20180358655-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SLC9A1, SLC8A1, SLC9A2 ALDH1A1 371/4885CASP1 811/4885HSD17B10 1007/4885

“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.