SCHEMBL3512019

SCHEMBL3512019

COC[C@H]1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 2/20 0.43
ALOX5AP P20292 1/20 0.43
FEN1 P39748 1/20 0.43
PDE8B O95263 1/20 0.42
NPC1 O15118 1/20 0.41
ATM Q13315 2/20 0.41
OPRD1 P41143 1/20 0.41
DPP4 P27487 1/20 0.41
DPP8 Q6V1X1 1/20 0.41
TSHR P16473 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL3512016 1.00 HSD17B10 (0.47) HSD17B10SMN1; SMN2ALDH1A1ALOX5APFEN1
SCHEMBL792043 1.00 HSD17B10 (0.47) HSD17B10SMN1; SMN2ALDH1A1ALOX5APFEN1
SCHEMBL5307883 0.95 PDE8B (0.46) HSD17B10SMN1; SMN2ALDH1A1ALOX5APFEN1
SCHEMBL12485875 0.95 PDE8B (0.46) HSD17B10SMN1; SMN2ALDH1A1ALOX5APFEN1
SCHEMBL5257475 0.95 PDE8B (0.46) HSD17B10SMN1; SMN2ALDH1A1ALOX5APFEN1
SCHEMBL4177435 0.90 HSD17B10 (0.40) HSD17B10SMN1; SMN2ALDH1A1ATM
SCHEMBL4177439 0.90 HSD17B10 (0.40) HSD17B10SMN1; SMN2ALDH1A1ATM
SCHEMBL70260 0.90 HSD17B10 (0.40) HSD17B10SMN1; SMN2ALDH1A1ATM
SCHEMBL21122413 0.88 HSD17B10 (0.47) HSD17B10SMN1; SMN2ALDH1A1ALOX5APFEN1
SCHEMBL24251932 0.87 DPP4 (0.39) HSD17B10ALDH1A1ALOX5APFEN1ATM

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230374015-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR KINASES KINNATE BIOPHARMA INC. 2023-11-23 US disclosed
US-8299267-B2 (3-hydroxy-4-amino-butan-2-yl) -3- (2-thiazol-2-yl-pyrrolidine-1-carbonyl) benzamide derivatives and related compounds as beta-secretase inhibitors for treating COMENTIS, INC. (US) 2012-10-30 US disclosed
US-20100286170-A1 (3-HYDROXY-4-AMINO-BUTAN-2-YL) -3- (2-THIAZOL-2-YL-PYRROLIDINE-1-CARBONYL) BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BETA-SECRETASE INHIBITORS FOR TREATING COMENTIS, INC 2010-11-11 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 (2 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-20230374015-A1 INHIBITORS OF FIBROBLAST GROWTH FACTOR RECEPTOR KINASES FGFR1, FGFR2, FGFR3 HSD17B10 2296/4885SMN1; SMN2 3037/4885ALDH1A1 2169/4885
US-20100286170-A1 (3-HYDROXY-4-AMINO-BUTAN-2-YL) -3- (2-THIAZOL-2-YL-PYRROLIDINE-1-CARBONYL) BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BETA-SECRETASE INHIBITORS FOR TREATING BACE1, BACE2, PSEN1 HSD17B10 792/4885SMN1; SMN2 2187/4885ALDH1A1 1430/4885

“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.