SCHEMBL327143

SCHEMBL327143

COC(=O)c1nc(-c2c(F)ccc(C(=O)NC(C)C)c2F)ccc1N

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM2 Q9P1W9 8/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
AR P10275 2/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA2 P47869 1/20 0.37
ABL1 P00519 1/20 0.36
RIPK1 Q13546 1/20 0.36
PIM1 P11309 7/20 0.36
PIM3 Q86V86 6/20 0.36
IRAK4 Q9NWZ3 1/20 0.35
MAPT P10636 2/20 0.34
ALOX5 P09917 1/20 0.34
NFKB1 P19838 1/20 0.34

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
SCHEMBL14902600 0.90 RIPK1 (0.36) PIM2ARGABRG2GABRB3GABRA2
SCHEMBL318644 0.90 AR (0.37) PIM2ARGABRG2GABRB3GABRA2
SCHEMBL319279 0.78 PIM2 (0.49) PIM2PIM1PIM3IRAK4ALDH1A1
SCHEMBL11978319 0.78 PIM2 (0.53) PIM2NPC1RAB9AARGABRG2
SCHEMBL11909711 0.76 MEN1 (0.38) PIM2SMN1; SMN2PIM1PIM3KDM4E
SCHEMBL319437 0.74 AR (0.37) PIM2ARGABRG2GABRB3GABRA2
SCHEMBL11907594 0.73 GABRG2 (0.39) PIM2ARGABRG2GABRB3GABRA2
SCHEMBL22924537 0.72 CES2 (0.53) NPC1SMN1; SMN2ARMAPTALOX5
SCHEMBL11909713 0.71 MAP2K3 (0.33) PIM2PIM1PIM3
SCHEMBL11909552 0.69 LMNA (0.38) PIM2NPC1RAB9ASMN1; SMN2SENP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590968-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS Novartis AG (CH) 2013-05-15 EP disclosed
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2013-05-02 US disclosed
US-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2013-05-02 US disclosed
WO-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 WO disclosed
WO-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 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-20130109682-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS PIM1, GSK3A, GSK3B PIM2 4/4885NPC1 2570/4885RAB9A 2542/4885

“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.