SCHEMBL4253115

SCHEMBL4253115

O=C(Nc1nc2ccc(NC(=O)c3sc4ccccc4c3Cl)cc2s1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRSS12 P56730 7/20 0.67
▸ PTPN7 P35236 1/20 0.62
▸ PTPN12 Q05209 1/20 0.62
▸ PTPN22 Q9Y2R2 1/20 0.62
▸ CASP3 P42574 3/20 0.61
▸ SENP7 Q9BQF6 3/20 0.61
▸ SENP6 Q9GZR1 3/20 0.61
▸ SENP8 Q96LD8 2/20 0.61
▸ SMN1; SMN2 Q16637 4/20 0.57
▸ NPC1 O15118 3/20 0.57
▸ RAB9A P51151 3/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ HTT P42858 1/20 0.56
▸ LRRK2 Q5S007 1/20 0.56
▸ SCD O00767 1/20 0.56
▸ DYRK1A Q13627 1/20 0.56
▸ PIN1 Q13526 1/20 0.56
▸ NTRK1 P04629 1/20 0.55
▸ MAPT P10636 2/20 0.55

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
SCHEMBL4249984 0.89 PTPN7 (0.63) PRSS12PTPN7PTPN12PTPN22CASP3
SCHEMBL4250099 0.85 MAPT (0.70) PRSS12PTPN7PTPN12PTPN22SMN1; SMN2
SCHEMBL4918623 0.83 PTPN7 (0.77) PRSS12PTPN7PTPN12PTPN22CASP3
SCHEMBL17916672 0.83 PTPN7 (0.67) PRSS12PTPN7PTPN12PTPN22CASP3
SCHEMBL29532955 0.78 CASP3 (0.65) CASP3SENP7SENP6SENP8SMN1; SMN2
SCHEMBL17251803 0.78 CASP3 (0.65) CASP3SENP7SENP6SENP8SMN1; SMN2
SCHEMBL28227108 0.77 CASP3 (0.62) CASP3SENP7SENP6SENP8SMN1; SMN2
SCHEMBL16562057 0.77 MAPT (0.72) PRSS12SMN1; SMN2NPC1RAB9AKMT2A
SCHEMBL23135818 0.76 DYRK1A (0.68) CASP3SENP7SENP6SENP8SMN1; SMN2
SCHEMBL4253000 0.76 CASP3 (0.61) CASP3SENP7SENP6SENP8SMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170914-A1 Cermide Kinase Modulation BORNANCIN FREDERIC 2009-07-02 — — US claimed
EP-2004617-A2 CERAMIDE KINASE MODULATION Novartis AG (CH) 2008-12-24 — — EP claimed
WO-2007112914-A2 CERAMIDE KINASE MODULATION NOVARTIS AG (CH) 2007-10-11 — — WO claimed
US-20090170914-A1 Cermide Kinase Modulation BORNANCIN FREDERIC 2009-07-02 — — US disclosed
US-20090170914-A1 Cermide Kinase Modulation BORNANCIN FREDERIC 2009-07-02 — — US disclosed
US-20090170914-A1 Cermide Kinase Modulation BORNANCIN FREDERIC 2009-07-02 — — US disclosed
EP-2004617-A2 CERAMIDE KINASE MODULATION Novartis AG (CH) 2008-12-24 — — EP disclosed
WO-2007112914-A2 CERAMIDE KINASE MODULATION NOVARTIS AG (CH) 2007-10-11 — — WO disclosed
WO-2007112914-A2 CERAMIDE KINASE MODULATION NOVARTIS AG (CH) 2007-10-11 — — 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-20090170914-A1 Cermide Kinase Modulation CERS2, CHKB, SPHK2 PRSS12 1711/4885PTPN7 2659/4885PTPN12 2674/4885

“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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