SCHEMBL16234425

SCHEMBL16234425

CCCCO[C@@H]1C(NCC(=O)c2ccccc2)[C@H](OC)OC(COC(C)=O)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.38
▸ KMT2A Q03164 1/20 0.37
▸ TNF P01375 2/20 0.37
▸ LGALS8 O00214 2/20 0.36
▸ LGALS3 P17931 2/20 0.36
▸ SSTR5 P35346 7/20 0.36
▸ TSHR P16473 1/20 0.36
▸ SSTR2 P30874 3/20 0.34
▸ SSTR3 P32745 3/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ SSTR1 P30872 1/20 0.34
▸ SSTR4 P31391 1/20 0.34
▸ MCHR1 Q99705 1/20 0.33

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
SCHEMBL14473900 1.00 LMNA (0.38) LMNAKMT2ATNFLGALS8LGALS3
SCHEMBL16234426 0.91 LMNA (0.40) LMNAKMT2ATNFLGALS8LGALS3
SCHEMBL14474347 0.84 PAX8 (0.41) LMNAKMT2ATSHR
SCHEMBL16234429 0.84 PAX8 (0.41) LMNAKMT2ATSHR
SCHEMBL16232445 0.80 LMNA (0.44) LMNAKMT2ALGALS8LGALS3TSHR
SCHEMBL15581555 0.76 LMNA (0.64) LMNAKMT2ATSHRMAPK1
SCHEMBL16690984 0.76 LMNA (0.64) LMNAKMT2ATSHRMAPK1
SCHEMBL14479098 0.73 AGTR1 (0.39) KMT2ALGALS8LGALS3
SCHEMBL14479046 0.73 AGTR1 (0.39) KMT2ALGALS8LGALS3
SCHEMBL14478847 0.73 AGTR1 (0.39) KMT2ALGALS8LGALS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140336369-A1 PROCESS FOR PREPARING HEPARINOIDS AND INTERMEDIATES USEFUL IN THE SYNTHESIS THEREOF APICORE US LLC (US) 2014-11-13 — — 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 (1 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-20140336369-A1 PROCESS FOR PREPARING HEPARINOIDS AND INTERMEDIATES USEFUL IN THE SYNTHESIS THEREOF HPSE, STS, F11 LMNA 900/4885KMT2A 3385/4885TNF 1992/4885

“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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