SCHEMBL23868270

SCHEMBL23868270

COC(=O)Cc1cc(I)c(Cc2cc(I)c(OCCCN3CCNCC3)c(I)c2)c(I)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ HRH2 P25021 1/20 0.38
▸ HRH1 P35367 1/20 0.38
▸ ITGB3 P05106 6/20 0.38
▸ ITGAV P06756 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ITGA2B P08514 5/20 0.37
▸ ROCK2 O75116 1/20 0.36
▸ ROCK1 Q13464 1/20 0.36
▸ SIRT3 Q9NTG7 1/20 0.35
▸ EPHX2 P34913 1/20 0.34

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
SCHEMBL6852144 0.76 ITGB3 (0.49) MEN1KMT2AITGB3ITGAVALDH1A1
SCHEMBL4139801 0.68 KDM4E (0.60) ALDH1A1MAPTSMN1; SMN2ROCK2ROCK1
SCHEMBL6852102 0.66 THRB (0.51) MEN1KMT2AITGB3ITGAVALDH1A1
SCHEMBL7310808 0.65 MEN1 (0.49) MEN1KMT2AHRH2HRH1ALDH1A1
SCHEMBL16167659 0.65 ITGB3 (0.50) MEN1KMT2AITGB3ITGAVALDH1A1
SCHEMBL6857392 0.64 THRB (0.52) MEN1KMT2AITGB3ITGAVALDH1A1
SCHEMBL20365512 0.64 MEN1 (0.46) MEN1KMT2AHRH2HRH1ALDH1A1
SCHEMBL31465622 0.64 MEN1 (0.48) MEN1KMT2AHRH2HRH1ALDH1A1
Hydrochloric Acid SCHEMBL28437307 0.64 MEN1 (0.48) MEN1KMT2AHRH2HRH1ALDH1A1
Hydrochloric Acid SCHEMBL7500429 0.63 MAPT (0.53) MEN1KMT2AALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11351137-B2 Composition and method for dual targeting in treatment of neuroendocrine tumors NANOPHARMACEUTICALS LLC (US) 2022-06-07 — — US disclosed
US-20210299262-A1 COMPOSITION AND METHOD FOR DUAL TARGETING IN TREATMENT OF NEUROENDOCRINE TUMORS NANOPHARMACEUTICALS LLC 2021-09-30 — — 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-11351137-B2 Composition and method for dual targeting in treatment of neuroendocrine tumors THRB, TSHR, SLC6A2 MEN1 100/4885KMT2A 3019/4885HRH2 1516/4885
US-20210299262-A1 COMPOSITION AND METHOD FOR DUAL TARGETING IN TREATMENT OF NEUROENDOCRINE TUMORS THRB, TSHR, SLC6A2 MEN1 100/4885KMT2A 3019/4885HRH2 1516/4885

“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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