SCHEMBL13227693

SCHEMBL13227693

COc1ccc(C(NC(=O)OCC2c3ccccc3-c3ccccc32)c2ccc(OCC(=O)CNC(c3ccccc3)c3ccc(C)cc3)cc2)c(OC)c1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.45
▸ MEN1 O00255 6/20 0.45
▸ MDM2 Q00987 2/20 0.39
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ ADAMTS5 Q9UNA0 2/20 0.37
▸ CASP3 P42574 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ THRA P10827 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ FABP5 Q01469 1/20 0.35

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
SCHEMBL12200636 0.98 KMT2A (0.43) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL14450381 0.92 KMT2A (0.46) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL31749265 0.90 KMT2A (0.54) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL27214060 0.90 KMT2A (0.54) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL13379273 0.90 KMT2A (0.42) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL31146900 0.89 KMT2A (0.45) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL3367289 0.89 KMT2A (0.45) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL29470540 0.89 KMT2A (0.45) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL29368397 0.89 KMT2A (0.45) KMT2AMEN1MDM2NPC1RAB9A
SCHEMBL1745934 0.89 KMT2A (0.45) KMT2AMEN1MDM2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100210552-A1 HUMAN GLUCAGON-LIKE PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2010-08-19 — — US disclosed
US-7314726-B2 Beta secretase exosite binding peptides and methods for identifying beta secretase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-01 — — US disclosed
US-20070287670-A1 HUMAN GLUCAGON-LIKE PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-12-13 — — US disclosed
US-20070149763-A1 Beta secretase exosite binding peptides and methods for identifying beta secretase modulators BRISTOL-MYERS SQUIBB COMPANY 2007-06-28 — — 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-20070287670-A1 HUMAN GLUCAGON-LIKE PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS GLP1R, IAPP, GIPR KMT2A 3701/4885MEN1 247/4885MDM2 3231/4885
US-20100210552-A1 HUMAN GLUCAGON-LIKE PEPTIDE-1 MIMICS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS GLP1R, IAPP, GIPR KMT2A 3701/4885MEN1 247/4885MDM2 3231/4885
US-20070149763-A1 Beta secretase exosite binding peptides and methods for identifying beta secretase modulators BACE1, BACE2, APP KMT2A 4054/4885MEN1 1288/4885MDM2 726/4885

“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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