SCHEMBL22861375

SCHEMBL22861375

CCOC(=O)NCCCN1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.61
GAA P10253 2/20 0.57
LMNA P02545 4/20 0.56
KDM4E B2RXH2 2/20 0.56
POLB P06746 2/20 0.56
HPGD P15428 2/20 0.55
DUSP3 P51452 1/20 0.55
HSD17B10 Q99714 1/20 0.55
MAPK1 P28482 1/20 0.54
HIF1A Q16665 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.53
RAB9A P51151 1/20 0.52
TP53 P04637 1/20 0.52
PAOX Q6QHF9 1/20 0.50

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
SCHEMBL2759481 0.91 TDP1 (0.57) ALDH1A1POLB
SCHEMBL8588760 0.86 ACHE (0.60) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL24925717 0.86 GAA (0.62) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL22861473 0.81 ALDH1A1 (0.64) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL8588183 0.81 ACHE (0.54) ALDH1A1
SCHEMBL22281957 0.81 ALDH1A1 (0.59) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL39968 0.81 LMNA (0.58) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL7888060 0.81 ALDH1A1 (0.50) ALDH1A1GAALMNAKDM4EHPGD
SCHEMBL76649 0.80 GAA (0.68) ALDH1A1GAALMNAKDM4EPOLB
SCHEMBL22890926 0.80 ALDH1A1 (0.63) ALDH1A1GAALMNAKDM4EHPGD

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
WO-2021195599-A1 MTORC1 MODULATORS AND USES THEREOF AEOVIAN PHARMACEUTICALS, INC. (US) 2021-09-30 WO disclosed
US-11021492-B2 mTORC modulators and uses thereof AEOVIAN PHARMACEUTICALS, INC. (US) 2021-06-01 US disclosed
US-20210002300-A1 MTORC MODULATORS AND USES THEREOF AEOVIAN PHARMACEUTICALS, INC. 2021-01-07 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-20210002300-A1 MTORC MODULATORS AND USES THEREOF MTOR, RICTOR, RPTOR ALDH1A1 4766/4885GAA 2390/4885LMNA 4444/4885
US-11021492-B2 mTORC modulators and uses thereof MTOR, RICTOR, RPTOR ALDH1A1 4766/4885GAA 2390/4885LMNA 4444/4885

“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.