SCHEMBL16640877

SCHEMBL16640877

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nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GJB2 P29033 1/20 0.46
MAPK1 P28482 1/20 0.45
MMP13 P45452 1/20 0.43
PYGB P11216 2/20 0.41
LGALS8 O00214 2/20 0.41
LGALS3 P17931 2/20 0.41
LGALS4 P56470 2/20 0.41
SLC5A1 P13866 1/20 0.40
SLC5A2 P31639 1/20 0.40
GAA P10253 1/20 0.40
IGF2R P11717 1/20 0.40

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
SCHEMBL30391777 0.93 MAPK1 (0.53) GJB2MAPK1MMP13PYGB
SCHEMBL4298713 0.92 MAPK1 (0.55) GJB2MAPK1MMP13
SCHEMBL14506448 0.92 MAPK1 (0.55) GJB2MAPK1MMP13
SCHEMBL16092453 0.92 MAPK1 (0.55) GJB2MAPK1MMP13
SCHEMBL12141519 0.91 GJB2 (0.44) GJB2MAPK1MMP13LGALS8LGALS3
SCHEMBL17776426 0.91 GJB2 (0.44) GJB2MAPK1MMP13PYGBLGALS8
SCHEMBL17776036 0.90 MAPK1 (0.45) GJB2MAPK1MMP13LGALS8LGALS3
SCHEMBL16644847 0.90 MAPK1 (0.45) GJB2MAPK1MMP13LGALS8LGALS3
SCHEMBL19841402 0.90 MMP13 (0.43) GJB2MAPK1MMP13LGALS8LGALS3
SCHEMBL16644882 0.90 MAPK1 (0.45) GJB2MAPK1MMP13LGALS8LGALS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9889205-B2 Glucose-responsive insulin conjugates MERCK SHARP & DOHME CORP. (US) 2018-02-13 US disclosed
US-9884125-B2 Glucose-responsive insulin conjugates MERCK SHARP & DOHME CORP. (US) 2018-02-06 US disclosed
US-20160303244-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2016-10-20 US disclosed
US-20160251407-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME CORP. (US) 2016-09-01 US disclosed
US-9427475-B2 Glucose-responsive insulin conjugates MERCK SHARP & DOHME CORP. (US) 2016-08-30 US disclosed
US-20150105317-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME LLC 2015-04-16 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 (3 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-20150105317-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES GPR119, INSR, IRS1 GJB2 3707/4885MAPK1 1090/4885MMP13 3215/4885
US-20160251407-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES GPR119, INSR, IRS1 GJB2 4032/4885MAPK1 1013/4885MMP13 3498/4885
US-20160303244-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES GPR119, INSR, IRS1 GJB2 3707/4885MAPK1 1090/4885MMP13 3215/4885

“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.