SCHEMBL6552485

SCHEMBL6552485

COC(=O)N(CCO)CCO

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
CA14 Q9ULX7 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
ALDH2 P05091 1/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
CYP4A11 Q02928 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL16374243 0.90 MEN1 (0.32) MAPTCA12CA1CA2CA9
SCHEMBL304728 0.79 CA12 (0.48) CA12CA1CA2CA9MEN1
SCHEMBL10716993 0.78 TSHR (0.39) MAPTCA12CA1CA2CA9
SCHEMBL3186938 0.78
SCHEMBL25285799 0.77 MEN1 (0.33) CA12CA2CA9MEN1KMT2A
SCHEMBL10244731 0.77
SCHEMBL6200197 0.77 MEN1 (0.33) MAPTMEN1KMT2AALDH1A1TSHR
SCHEMBL18154102 0.75 HDAC1 (0.51) MAPTALDH1A1POLBGAA
SCHEMBL304950 0.75 CA1 (0.52) CA12CA1CA2CA9ALDH1A1
SCHEMBL22167852 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4272825-A2 MTORC MODULATORS AND USES THEREOF Aeovian Pharmaceuticals, Inc. (US) 2023-11-08 EP disclosed
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
WO-2020154447-A1 MTORC MODULATORS AND USES THEREOF AEOVIAN PHARMACEUTICALS, INC. (US) 2020-07-30 WO disclosed
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-7619092-B2 Piperidine compounds MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-17 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-08-06 US disclosed
EP-1070045-B1 METHODS FOR THE PREPARATION OF AN N-BIS- 2-(1,2-DICARBOXY-ETHOXY)-ETHYL]AMINE DERIVATIVE AND PRODUCTS OF THE METHODS AND THEIR USES KEMIRA CHEMICALS OY (FI) 2004-02-18 EP disclosed
EP-1070045-A1 METHODS FOR THE PREPARATION OF AN N-BIS- 2-(1,2-DICARBOXY-ETHOXY)-ETHYL]AMINE DERIVATIVE AND PRODUCTS OF THE METHODS AND THEIR USES KEMIRA CHEMICALS OY (FI) 2001-01-24 EP disclosed
WO-1999046234-A1 METHODS FOR THE PREPARATION OF AN N-BIS-[2-(1,2-DICARBOXY-ETHOXY)-ETHYL]AMINE DERIVATIVE AND PRODUCTS OF THE METHODS AND THEIR USES KEMIRA CHEMICALS OY (FI) 1999-09-16 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 (3 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 MAPT 3533/4885CA12 4858/4885CA1 4866/4885
US-20090198052-A1 METHOD FOR PREPARING OPTICALLY ACTIVE PIPERIDINE COMPOUNDS SNCA, SYNJ1, KCNH2 MAPT 1047/4885CA12 2453/4885CA1 1003/4885
US-11021492-B2 mTORC modulators and uses thereof MTOR, RICTOR, RPTOR MAPT 3533/4885CA12 4858/4885CA1 4866/4885

“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.