SCHEMBL3020705

SCHEMBL3020705

CC(C)Nc1cc(C(F)(F)F)cc2nc(NC(=O)c3ccc(CN4CCOCC4)nc3)nn12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 4/20 0.58
▸ EPAS1 Q99814 4/20 0.58
▸ MAP3K5 Q99683 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ DDR1 Q08345 2/20 0.38
▸ DDR2 Q16832 2/20 0.38
▸ BTK Q06187 2/20 0.38
▸ BRAF P15056 4/20 0.38
▸ RAF1 P04049 2/20 0.38
▸ RET P07949 1/20 0.37
▸ LCK P06239 1/20 0.37
▸ SRC P12931 1/20 0.37
▸ TYK2 P29597 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ SYK P43405 1/20 0.37
▸ MAPK8 P45983 1/20 0.37
▸ MAPK9 P45984 1/20 0.37
▸ JAK3 P52333 1/20 0.37

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
SCHEMBL2774279 0.82 MAP3K5 (0.55) MAP3K5
SCHEMBL2790152 0.81 MAP3K5 (0.52) MAP3K5ALDH1A1GAAMAPTSMN1; SMN2
SCHEMBL2789454 0.78 MAP3K5 (0.47) MAP3K5LCKSRCKDR
SCHEMBL2812561 0.77 MAP3K5 (0.73) MAP3K5BRAFMAPTSMN1; SMN2EPHX2
SCHEMBL2790189 0.76 HIF1A (0.47) HIF1AEPAS1MAP3K5HRH3TYK2
SCHEMBL2789598 0.74 MAP3K5 (0.66) MAP3K5ALDH1A1GAABRAFRAF1
SCHEMBL2811182 0.71 MAP3K5 (0.51) MAP3K5ALDH1A1GAA
SCHEMBL2787990 0.71 MAP3K5 (0.68) MAP3K5ALDH1A1GAABRAFMAPT
SCHEMBL3024342 0.71 MAP3K5 (0.71) MAP3K5BTK
SCHEMBL2788166 0.70 RAB9A (0.48) HIF1AEPAS1TYK2JAK3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120238565-A1 TRIAZOLOPYRIDINE COMPOUNDS AND THEIR USE AS ASK INHIBITORS MERCK SERONO SA (CH) 2012-09-20 — — US claimed
US-8263595-B2 Triazolopyridine compounds and their use as ask inhibitors MERCK SERONO SA (CH) 2012-09-11 — — US claimed
US-20100197681-A1 Triazolopyridine Compounds and Their Use as Ask Inhibitors MERCK SERONO SA (CH) 2010-08-05 — — US claimed
US-20120238565-A1 TRIAZOLOPYRIDINE COMPOUNDS AND THEIR USE AS ASK INHIBITORS MERCK SERONO SA (CH) 2012-09-20 — — US disclosed
US-20120238565-A1 TRIAZOLOPYRIDINE COMPOUNDS AND THEIR USE AS ASK INHIBITORS MERCK SERONO SA (CH) 2012-09-20 — — US disclosed
US-20120238565-A1 TRIAZOLOPYRIDINE COMPOUNDS AND THEIR USE AS ASK INHIBITORS MERCK SERONO SA (CH) 2012-09-20 — — US disclosed
US-8263595-B2 Triazolopyridine compounds and their use as ask inhibitors MERCK SERONO SA (CH) 2012-09-11 — — US disclosed
US-8263595-B2 Triazolopyridine compounds and their use as ask inhibitors MERCK SERONO SA (CH) 2012-09-11 — — US disclosed
US-8263595-B2 Triazolopyridine compounds and their use as ask inhibitors MERCK SERONO SA (CH) 2012-09-11 — — US disclosed
US-20100197681-A1 Triazolopyridine Compounds and Their Use as Ask Inhibitors MERCK SERONO SA (CH) 2010-08-05 — — US disclosed
US-20100197681-A1 Triazolopyridine Compounds and Their Use as Ask Inhibitors MERCK SERONO SA (CH) 2010-08-05 — — US disclosed
US-20100197681-A1 Triazolopyridine Compounds and Their Use as Ask Inhibitors MERCK SERONO SA (CH) 2010-08-05 — — 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 (2 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-20100197681-A1 Triazolopyridine Compounds and Their Use as Ask Inhibitors MAP3K5, MAPKAPK5, MAP3K9 HIF1A 3381/4885EPAS1 1274/4885MAP3K5 1/4885
US-20120238565-A1 TRIAZOLOPYRIDINE COMPOUNDS AND THEIR USE AS ASK INHIBITORS MAP3K5, MAPKAPK5, MAP3K9 HIF1A 3381/4885EPAS1 1274/4885MAP3K5 1/4885

“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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