SCHEMBL1709105

SCHEMBL1709105

CCC(=O)NC[C@H](O)[C@@H](O)C[C@H](O)CO

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PSMB5 P28074 1/20 0.36
MTNR1A P48039 3/20 0.32
MTNR1B P49286 3/20 0.32
HTR2C P28335 2/20 0.32
CYP2C9 P11712 1/20 0.31
NEU1 Q99519 1/20 0.30
NEU2 Q9Y3R4 1/20 0.30

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
SCHEMBL22429688 0.85 MEN1 (0.38) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL19688544 0.85 MEN1 (0.38) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL22429690 0.85 MEN1 (0.38) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL16357807 0.84 MEN1 (0.34) MEN1KMT2APSMB5
SCHEMBL15943619 0.82 MEN1 (0.44) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL12719510 0.82 MEN1 (0.44) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL9080368 0.82 MEN1 (0.44) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL19661531 0.77 MEN1 (0.40) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL19455924 0.77 MEN1 (0.40) MEN1KMT2APSMB5MTNR1AMTNR1B
SCHEMBL22430007 0.77 KDM4E (0.52) MEN1KMT2APSMB5MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210154311-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE INC (US) 2021-05-27 US disclosed
US-20210154312-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS ENDOCYTE, INC. 2021-05-27 US disclosed
US-20170348376-A1 TUBULYSIN CONJUGATE FOR USE IN TREATING CANCER ENDOCYTE, INC. 2017-12-07 US disclosed
WO-2017205661-A1 METHOD OF TREATING CANCER BY TARGETING MYELOID-DERIVED SUPPRESSOR CELLS PURDUE RESEARCH FOUNDATION (US) 2017-11-30 WO disclosed
WO-2009002993-A1 CONJUGATES CONTAINING HYDROPHILIC SPACER LINKERS ENDOCYTE, INC. (US) 2008-12-31 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-20210154311-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 MEN1 186/4885KMT2A 961/4885PSMB5 1032/4885
US-20210154312-A1 CONJUGATES FOR TREATING DISEASES CAUSED BY PSMA EXPRESSING CELLS FOLH1, KLK3, CD47 MEN1 186/4885KMT2A 961/4885PSMB5 1032/4885
US-20170348376-A1 TUBULYSIN CONJUGATE FOR USE IN TREATING CANCER FOLH1, FOLR1, FOLR2 MEN1 513/4885KMT2A 1877/4885PSMB5 3808/4885

“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.