SCHEMBL25099301

SCHEMBL25099301

CCOC(CC(=O)O)C[N+](C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CYP1A2 P05177 4/20 0.54
MAPT P10636 5/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
MAPK1 P28482 4/20 0.53
GMNN O75496 3/20 0.53
NPSR1 Q6W5P4 3/20 0.53
TP53 P04637 3/20 0.53
TSHR P16473 3/20 0.53
HSP90AA1 P07900 2/20 0.53
BLM P54132 2/20 0.53
NR1H4 Q96RI1 2/20 0.53
CYP2C9 P11712 2/20 0.53
HIF1A Q16665 2/20 0.53
GLA P06280 1/20 0.51
PMP22 Q01453 1/20 0.51
CYP2C19 P33261 2/20 0.43
RECQL P46063 1/20 0.43

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
SCHEMBL25099742 1.00 LMNA (0.59) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL28289121 0.84 LMNA (0.59) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL17969447 0.82 MEN1 (0.64) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL10496268 0.82 MEN1 (0.64) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL28320795 0.82 CYP1A2 (0.60) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL15198699 0.81 LMNA (0.56) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL29022745 0.81 LMNA (0.56) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL29050650 0.81 LMNA (0.56) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL29112155 0.80 LMNA (0.51) LMNASMN1; SMN2CYP1A2MAPTMEN1
SCHEMBL21877827 0.80 LMNA (0.51) LMNASMN1; SMN2CYP1A2MAPTMEN1

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-12037354-B2 Cyclic pantetheine derivatives and uses thereof VECTIVBIO COMET AG (CH) 2024-07-16 US disclosed
US-20230072313-A1 CYCLIC PANTETHEINE DERIVATIVES AND USES THEREOF VECTIVBIO COMET AG, F/K/A COMET THERAPEUTICS, INC. (CH) 2023-03-09 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-20230072313-A1 CYCLIC PANTETHEINE DERIVATIVES AND USES THEREOF VNN1, VKORC1, PANK3 LMNA 1802/4885SMN1; SMN2 3480/4885CYP1A2 503/4885
US-12037354-B2 Cyclic pantetheine derivatives and uses thereof VNN1, VKORC1, PANK3 LMNA 1802/4885SMN1; SMN2 3480/4885CYP1A2 503/4885

“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.