SCHEMBL18655411

SCHEMBL18655411

COC(=O)CCCCCCCCCCCCCCCCCOC(=O)N[C@H]1C[C@H](O[C@H]2C[C@](O)(C(=O)CO)Cc3c(O)c4c(c(O)c32)C(=O)c2c(OC)cccc2C4=O)O[C@@H](C)[C@H]1O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.70
▸ KMT2A Q03164 8/20 0.70
▸ THRB P10828 7/20 0.70
▸ BLM P54132 6/20 0.70
▸ TOP2A P11388 5/20 0.70
▸ RECQL P46063 5/20 0.70
▸ TDP1 Q9NUW8 5/20 0.70
▸ HIF1A Q16665 4/20 0.70
▸ SMN1; SMN2 Q16637 4/20 0.70
▸ HTT P42858 4/20 0.70
▸ BRCA1 P38398 4/20 0.70
▸ PTGS1 P23219 3/20 0.70
▸ CHRM1 P11229 3/20 0.70
▸ TBXA2R P21731 3/20 0.70
▸ KDM4E B2RXH2 3/20 0.70
▸ ALDH1A1 P00352 3/20 0.70
▸ MAPT P10636 3/20 0.70
▸ MAPK1 P28482 3/20 0.70
▸ ABCB1 P08183 3/20 0.70
▸ FYN P06241 2/20 0.70

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
SCHEMBL18689536 1.00 MEN1 (0.70) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL21215950 0.91 MEN1 (0.74) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL23625011 0.91 MEN1 (0.70) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL17706678 0.91 MEN1 (0.77) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL30465123 0.90 MEN1 (0.80) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL10014019 0.90 MEN1 (0.80) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL23117400 0.90 MEN1 (0.67) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL31680273 0.90 MEN1 (0.67) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL23135649 0.90 MEN1 (0.73) MEN1KMT2ATHRBBLMTOP2A
SCHEMBL23136499 0.89 MEN1 (0.71) MEN1KMT2ATHRBBLMTOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210047338-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-02-18 — — US disclosed
US-10654864-B2 Modified cytotoxins and their therapeutic use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-05-19 — — US disclosed
US-10286079-B2 Modified cytotoxins and their therapeutic use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-05-14 — — US disclosed
US-20180222915-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-08-09 — — US disclosed
US-20180222915-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-08-09 — — US disclosed
US-10023581-B2 Modified cytotoxins and their therapeutic use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-07-17 — — US disclosed
US-10023581-B2 Modified cytotoxins and their therapeutic use THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-07-17 — — US disclosed
US-20180000951-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-01-04 — — US disclosed
US-20170080094-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-03-23 — — US disclosed
US-20170080094-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-03-23 — — 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 (7 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-10023581-B2 Modified cytotoxins and their therapeutic use ANXA5, TP53, FABP1 MEN1 4053/4885KMT2A 3903/4885THRB 4636/4885
US-10286079-B2 Modified cytotoxins and their therapeutic use ANXA5, TP53, FABP1 MEN1 4053/4885KMT2A 3903/4885THRB 4636/4885
US-20180222915-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE ANXA5, TP53, FABP1 MEN1 4053/4885KMT2A 3903/4885THRB 4636/4885
US-20180000951-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE ANXA5, TP53, FABP1 MEN1 4053/4885KMT2A 3903/4885THRB 4636/4885
US-20210047338-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE ANXA5, TP53, FABP1 MEN1 4053/4885KMT2A 3903/4885THRB 4636/4885
US-20170080094-A1 MODIFIED CYTOTOXINS AND THEIR THERAPEUTIC USE ANXA5, TP53, FABP1 MEN1 4053/4885KMT2A 3903/4885THRB 4636/4885
US-10654864-B2 Modified cytotoxins and their therapeutic use ANXA5, TP53, FABP1 MEN1 4053/4885KMT2A 3903/4885THRB 4636/4885

“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.

Send feedback