SCHEMBL18733215

SCHEMBL18733215

CCCCOC1OC(CO)[C@@H](OCCCC)C(OCCCC)C1OCCCC

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.44
▸ GJB2 P29033 1/20 0.40
▸ LGALS8 O00214 2/20 0.40
▸ LGALS3 P17931 2/20 0.40
▸ LGALS4 P56470 2/20 0.40
▸ GBA1 P04062 1/20 0.38
▸ TNF P01375 1/20 0.37
▸ FGF1 P05230 3/20 0.34
▸ FGF2 P09038 3/20 0.34
▸ VEGFA P15692 3/20 0.34
▸ HPSE Q9Y251 3/20 0.34
▸ SLC2A1 P11166 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
SCHEMBL15508127 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL17300175 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL15508089 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL18030218 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL18333048 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL17300176 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL16079127 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL18733408 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL12819629 1.00 MAPK1 (0.44) MAPK1GJB2LGALS8LGALS3LGALS4
SCHEMBL9547050 0.93 MAPK1 (0.51) MAPK1GJB2LGALS8LGALS3LGALS4

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-20170102349-A1 ELECTROCHEMICAL METHODS AND COMPOUNDS FOR THE DETECTION OF ENZYMES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-04-13 — — 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-20170102349-A1 ELECTROCHEMICAL METHODS AND COMPOUNDS FOR THE DETECTION OF ENZYMES EPX, DNASE1, DERA MAPK1 3394/4885GJB2 3130/4885LGALS8 1316/4885

“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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