SCHEMBL18145803

SCHEMBL18145803

CC(=O)Oc1ccc2c(c1)Oc1cc(OC(C)=O)ccc1C21OC(=O)c2ccc(C(=O)NCCCC[C@H](NC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O)cc21

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ALB P02768 1/20 0.48
▸ FOLH1 Q04609 16/20 0.47
▸ GSTP1 P09211 1/20 0.47
▸ NAALAD2 Q9Y3Q0 1/20 0.41

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
SCHEMBL22895225 0.96 ALB (0.46) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL20341448 0.89 GSTP1 (0.49) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL14729474 0.87 LMNA (0.57) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL22434379 0.80 MEN1 (0.62) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL25457745 0.79 KMT2A (0.55) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL17970190 0.75 KMT2A (0.66) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL5277430 0.75 MEN1 (0.73) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL30112719 0.75 MEN1 (0.73) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL29349471 0.75 MEN1 (0.73) MEN1USP2ALDH1A1LMNAMAPT
SCHEMBL13435046 0.75 KMT2A (0.53) MEN1USP2ALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210032286-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2021-02-04 — — US disclosed
US-20210032286-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2021-02-04 — — US disclosed
US-20210024574-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2021-01-28 — — US disclosed
US-20210024574-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2021-01-28 — — US disclosed
US-20200377549-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2020-12-03 — — US disclosed
US-20200377549-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2020-12-03 — — US disclosed
US-20180258134-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2018-09-13 — — US disclosed
US-10011632-B2 PSMA imaging agents SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2018-07-03 — — US disclosed
US-10011632-B2 PSMA imaging agents SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2018-07-03 — — US disclosed
US-10011632-B2 PSMA imaging agents SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2018-07-03 — — US disclosed
US-20160304555-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2016-10-20 — — US disclosed
US-20160304555-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2016-10-20 — — US disclosed
US-20160304555-A1 PSMA Imaging Agents SIEMENS MEDICAL SOLUTIONS USA, INC. 2016-10-20 — — 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 (6 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-20180258134-A1 PSMA Imaging Agents FOLH1, KLK3, PSMA2 MEN1 59/4885USP2 3279/4885ALDH1A1 3049/4885
US-20200377549-A1 PSMA Imaging Agents FOLH1, KLK3, PSMA2 MEN1 59/4885USP2 3279/4885ALDH1A1 3049/4885
US-20210032286-A1 PSMA Imaging Agents FOLH1, KLK3, PSMA2 MEN1 59/4885USP2 3279/4885ALDH1A1 3049/4885
US-10011632-B2 PSMA imaging agents FOLH1, KLK3, PSMA2 MEN1 59/4885USP2 3279/4885ALDH1A1 3049/4885
US-20210024574-A1 PSMA Imaging Agents FOLH1, KLK3, PSMA2 MEN1 59/4885USP2 3279/4885ALDH1A1 3049/4885
US-20160304555-A1 PSMA Imaging Agents FOLH1, KLK3, PSMA2 MEN1 59/4885USP2 3279/4885ALDH1A1 3049/4885

“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.

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