SCHEMBL20599568

SCHEMBL20599568

CCOC(=O)CC(=O)C1CCCCN1C(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.46
FKBP1A P62942 3/20 0.46
HSD17B10 Q99714 2/20 0.46
LMNA P02545 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 2/20 0.42
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 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
SCHEMBL29147650 0.96 KMT2A (0.54) MEN1KMT2ASMN1; SMN2HSD17B10LMNA
SCHEMBL2426302 0.96 KMT2A (0.54) MEN1KMT2ASMN1; SMN2HSD17B10LMNA
SCHEMBL14573641 0.96 KMT2A (0.54) MEN1KMT2ASMN1; SMN2HSD17B10LMNA
SCHEMBL18787688 0.89 HSD17B10 (0.50) MEN1KMT2ASMN1; SMN2FKBP1AHSD17B10
SCHEMBL18787687 0.89 HSD17B10 (0.50) MEN1KMT2ASMN1; SMN2FKBP1AHSD17B10
Ethylmalonate SCHEMBL29947022 0.85 KMT2A (0.46) MEN1KMT2ASMN1; SMN2HSD17B10LMNA
Hydrochloric Acid SCHEMBL29946917 0.85 KMT2A (0.46) MEN1KMT2ASMN1; SMN2HSD17B10LMNA
SCHEMBL24358344 0.84 FKBP1A (0.64) MEN1KMT2ASMN1; SMN2FKBP1AHSD17B10
SCHEMBL15893182 0.84 FKBP1A (0.64) MEN1KMT2ASMN1; SMN2FKBP1AHSD17B10
SCHEMBL444202 0.84 FKBP1A (0.64) MEN1KMT2ASMN1; SMN2FKBP1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3814326-A1 DIHYDROPYRIMIDINE DERIVATIVES AND USES THEREOF IN THE TREATMENT OF HBV INFECTION OR OF HBV-INDUCED DISEASES Janssen Sciences Ireland Unlimited Company (IE) 2021-05-05 EP disclosed
US-10703746-B2 Mutant IDH1 inhibitors useful for treating cancer THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2020-07-07 US disclosed
EP-3645516-A1 HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS Janssen Pharmaceutica NV (BE) 2020-05-06 EP disclosed
WO-2019001420-A1 HETEROARYLDIHYDROPYRIMIDINE DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS JANSSEN PHARMACEUTICA NV (BE) 2019-01-03 WO 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-10703746-B2 Mutant IDH1 inhibitors useful for treating cancer IDH1, IDH3B, IDH3A MEN1 81/4885KMT2A 221/4885SMN1; SMN2 1967/4885

“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.