SCHEMBL16705802

SCHEMBL16705802

CC[C@H](C)[C@H](NC(=O)C(C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(CC(C)C)NC(=O)[C@@H](NC(=O)C(CCCCN)NNC(C)(C)C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C(C)C)C(=O)NC(C=O)Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.55
▸ GLP1R P43220 8/20 0.52
▸ PTH1R Q03431 3/20 0.52
▸ NPBWR1 P48145 1/20 0.51
▸ IL23R Q5VWK5 6/20 0.50

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
SCHEMBL2469583 0.86 RXFP1 (0.61) RXFP1GLP1RPTH1RIL23R
SCHEMBL14769532 0.83 GLP1R (0.67) RXFP1GLP1R
SCHEMBL16509035 0.82 NPBWR1 (0.61) RXFP1GLP1RNPBWR1IL23R
SCHEMBL16508984 0.82 NPBWR1 (0.61) RXFP1GLP1RNPBWR1IL23R
SCHEMBL30038811 0.81 RXFP1 (0.72) RXFP1GLP1RPTH1RNPBWR1IL23R
SCHEMBL29568300 0.81 KISS1R (0.61) RXFP1PTH1RNPBWR1
SCHEMBL29568099 0.81 KISS1R (0.61) RXFP1PTH1RNPBWR1
SCHEMBL30052890 0.81 KISS1R (0.60) RXFP1GLP1RPTH1RNPBWR1IL23R
SCHEMBL30817659 0.81 KISS1R (0.65) —
SCHEMBL30092970 0.80 NPBWR1 (0.59) RXFP1GLP1RPTH1RNPBWR1

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-9133181-B2 Substituted 6-(4-hydroxy-phenyl)-1H-pyrazolo[3,4-b]pyridine derivatives as kinase inhibitors SANOFI (FR) 2015-09-15 — — US disclosed
US-20150133432-A1 SUBSTITUTED 6-(4-HYDROXY-PHENYL)-1H-PYRAZOLO[3,4-B]PYRIDINE DERIVATIVES AS KINASE INHIBITORS SANOFI (FR) 2015-05-14 — — 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-20150133432-A1 SUBSTITUTED 6-(4-HYDROXY-PHENYL)-1H-PYRAZOLO[3,4-B]PYRIDINE DERIVATIVES AS KINASE INHIBITORS MAP3K1, MAP3K6, MAP3K19 RXFP1 1360/4885GLP1R 246/4885PTH1R 4077/4885

“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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