SCHEMBL1922423

SCHEMBL1922423

CS(=O)(=O)N1CCc2c(cccc2Nc2ccc(Cl)c(-c3nc(-c4ccccc4)co3)c2)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
SMO Q99835 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
RET P07949 1/20 0.35
JAK2 O60674 1/20 0.35
JAK3 P52333 1/20 0.35
BACE1 P56817 1/20 0.34
HTR6 P50406 1/20 0.33
HSD11B1 P28845 1/20 0.33
FAAH O00519 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
KAT2B Q92831 1/20 0.33

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
SCHEMBL1922092 0.79 SMO (0.42) LMNASMN1; SMN2SMOJAK2JAK3
SCHEMBL303677 0.78 PTGDR2 (0.40) LMNASMN1; SMN2NPC1RAB9AJAK2
SCHEMBL305390 0.77 PTGDR2 (0.39) LMNASMN1; SMN2NPC1RAB9AJAK2
SCHEMBL325117 0.76 TUBB4A (0.39) LMNASMN1; SMN2HTR6HSD11B1AKR1C3
SCHEMBL303036 0.73 JAK3 (0.37) LMNASMN1; SMN2JAK2JAK3PTGDR2
SCHEMBL302725 0.73 JAK2 (0.40) LMNASMN1; SMN2NPC1RAB9AJAK2
SCHEMBL303642 0.73 JAK2 (0.39) JAK2JAK3FAAHPTGDR2BRD9
SCHEMBL16029502 0.72 PTGDR2 (0.34) LMNASMN1; SMN2JAK2JAK3FAAH
SCHEMBL305387 0.72 JAK2 (0.37) LMNASMN1; SMN2SMOJAK2JAK3
SCHEMBL302467 0.72 JAK2 (0.37) LMNASMN1; SMN2NPC1RAB9AJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328871-B1 HEDGEHOG PATHWAY MODULATORS NOVARTIS AG (CH) 2020-04-01 EP claimed
US-8507491-B2 Compounds and compositions as hedgehog pathway inhibitors IRM LLC (BM) 2013-08-13 US claimed
US-20110152282-A1 HEDGEHOG PATHWAY MODULATORS IRM LLC (BM) 2011-06-23 US claimed
US-9216964-B2 Hedgehog pathway modulators NOVARTIS AG (CH) 2015-12-22 US disclosed
US-9216964-B2 Hedgehog pathway modulators NOVARTIS AG (CH) 2015-12-22 US disclosed
US-20130296333-A1 HEDGEHOG PATHWAY MODULATORS IRM LLC (BM) 2013-11-07 US disclosed
US-20130296333-A1 HEDGEHOG PATHWAY MODULATORS IRM LLC (BM) 2013-11-07 US disclosed
US-8507491-B2 Compounds and compositions as hedgehog pathway inhibitors IRM LLC (BM) 2013-08-13 US disclosed
US-8507491-B2 Compounds and compositions as hedgehog pathway inhibitors IRM LLC (BM) 2013-08-13 US disclosed
US-20110152282-A1 HEDGEHOG PATHWAY MODULATORS IRM LLC (BM) 2011-06-23 US disclosed
US-20110152282-A1 HEDGEHOG PATHWAY MODULATORS IRM LLC (BM) 2011-06-23 US disclosed
EP-2328871-A2 HEDGEHOG PATHWAY MODULATORS IRM LLC (BM) 2011-06-08 EP disclosed
WO-2010027746-A2 HEDGEHOG PATHWAY MODULATORS IRM LLC (BM) 2010-03-11 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 (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-20130296333-A1 HEDGEHOG PATHWAY MODULATORS GLI1, SHH, SMO LMNA 4749/4885SMN1; SMN2 3060/4885TRPV1 4050/4885
US-20110152282-A1 HEDGEHOG PATHWAY MODULATORS GLI1, SHH, SMO LMNA 4790/4885SMN1; SMN2 3290/4885TRPV1 3673/4885

“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.