SCHEMBL1474531

SCHEMBL1474531

CCc1cc(C(C)=O)ccc1NS(C)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 2/20 0.51
NPC1 O15118 1/20 0.48
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PKM P14618 1/20 0.44
NEU3 Q9UQ49 1/20 0.43
PRKCI P41743 1/20 0.42
RECQL P46063 1/20 0.42
POLB P06746 1/20 0.42
HSD17B1 P14061 1/20 0.41
ADRB3 P13945 1/20 0.40
NR3C1 P04150 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
PLA2G7 Q13093 1/20 0.39

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
SCHEMBL1475120 0.86 ADRB3 (0.45) SMN1; SMN2ALDH1A1NPC1HPGDKDM4E
SCHEMBL1474880 0.80 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1NPC1HPGDKDM4E
SCHEMBL9624564 0.79 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1NPC1HPGDKDM4E
SCHEMBL9537164 0.79 PRKCI (0.65) SMN1; SMN2ALDH1A1NPC1HPGDKDM4E
SCHEMBL9624571 0.79 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1NPC1HPGDKDM4E
SCHEMBL5674438 0.79 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10
SCHEMBL12643380 0.78 PKM (0.47) SMN1; SMN2ALDH1A1NPC1HPGDPKM
SCHEMBL7110796 0.77 ALDH1A1 (0.51) SMN1; SMN2ALDH1A1NPC1HPGDKDM4E
SCHEMBL9535456 0.77 AKR1C3 (0.60) SMN1; SMN2ALDH1A1
SCHEMBL966589 0.77 ADRB3 (0.58) SMN1; SMN2ALDH1A1HPGDKDM4EHSD17B10

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-1861359-B1 N-(N-SULFONYLAMINOMETHYL)CYCLOPROPANECARBOXAMIDE DERIVATIVES USEFUL FOR THE TREATMENT OF PAIN PFIZER (US) 2012-11-14 EP disclosed
US-7915448-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2011-03-29 US disclosed
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS PFIZER INC 2010-02-11 US disclosed
US-7622589-B2 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER INC. (US) 2009-11-24 US disclosed
US-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists PFIZER, INC. 2006-09-21 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-20060211741-A1 Substituted sulfonylaminoarylmethyl cyclopropanecarboxamide as VR1 receptor antagonists CNR1, HVCN1, CNR2 SMN1; SMN2 3171/4885ALDH1A1 1314/4885NPC1 728/4885
US-20100035880-A1 SUBSTITUTED SULFONYLAMINOARYLMETHYL CYCLOPROPANECARBOXAMIDE AS VR1 RECEPTOR ANTAGONISTS CNR1, HVCN1, CNR2 SMN1; SMN2 3122/4885ALDH1A1 1339/4885NPC1 735/4885

“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.