SCHEMBL1593855

SCHEMBL1593855

COc1ccc(Cn2nc(OC)c3cc(NC(=O)OC(C)(C)C)cnc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 1/20 0.44
▸ MKNK2 Q9HBH9 1/20 0.40
▸ NR3C1 P04150 3/20 0.40
▸ AAK1 Q2M2I8 1/20 0.40
▸ AKR1C3 P42330 5/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ CACNA1H O95180 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ AKR1C2 P52895 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ HDAC3 O15379 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38

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
SCHEMBL1593157 0.94 MEN1 (0.44) PTGDR2MKNK2NR3C1AAK1MEN1
SCHEMBL1592875 0.87 NR3C1 (0.45) PTGDR2NR3C1AKR1C3MEN1KMT2A
SCHEMBL1592988 0.80 MEN1 (0.47) PTGDR2NR3C1MEN1KMT2AHPGD
SCHEMBL28425625 0.79 PDE1B (0.48) MEN1KMT2AALDH1A1SMN1; SMN2CNR1
SCHEMBL28431943 0.77 PDE1B (0.49) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL28428236 0.77 PDE1B (0.47) NR3C1AKR1C3MEN1KMT2AHPGD
SCHEMBL24566406 0.77 CNR1 (0.50) HPGDHSD17B10ALDH1A1MAPTSMN1; SMN2
SCHEMBL28431878 0.74 CNR1 (0.47) HPGDHSD17B10ALDH1A1MAPTSMN1; SMN2
SCHEMBL1593023 0.74 CNR1 (0.47) MEN1KMT2AHPGDHSD17B10ALDH1A1
SCHEMBL1592906 0.74 PDE1B (0.55) HPGDHSD17B10ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109846843-A Desloratadine oral disnitegration tablet 浙江普利药业有限公司 2019-06-07 — — CN claimed
EP-2233543-B1 Composition for producing porous EVA coatings ROHM & HAAS (US) 2014-07-23 — — EP disclosed
US-8394795-B2 Pyrazole [3, 4-B] pyridine Raf inhibitors ARRAY BIOPHARMA INC. (US) 2013-03-12 — — US disclosed
EP-2265610-B1 PYRAZOLE [3, 4-B]PYRIDINE RAF INHIBITORS ARRAY BIOPHARMA INC (US) 2012-12-12 — — EP disclosed
US-8323746-B2 Composition for producing porous EVA coatings ROHM AND HAAS COMPANY (US) 2012-12-04 — — US disclosed
US-20110092479-A1 PYRAZOLE [3, 4-B] PYRIDINE RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2011-04-21 — — US disclosed
EP-2265610-A1 PYRAZOLE [3, 4-B]PYRIDINE RAF INHIBITORS Array Biopharma, Inc. (US) 2010-12-29 — — EP disclosed
US-20100247788-A1 COMPOSITION FOR PRODUCING POROUS EVA COATINGS ROHM AND HAAS COMPANY 2010-09-30 — — US disclosed
EP-2233543-A1 Composition for producing porous EVA coatings Rohm and Haas Company (US) 2010-09-29 — — EP disclosed
WO-2009111279-A1 PYRAZOLE [3, 4-B] PYRIDINE RAF INHIBITORS ARRAY BIOPHARMA INC. (US) 2009-09-11 — — WO 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-20110092479-A1 PYRAZOLE [3, 4-B] PYRIDINE RAF INHIBITORS BRAF, RAF1, ARAF PTGDR2 2285/4885MKNK2 360/4885NR3C1 1529/4885

“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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