SCHEMBL2206733

SCHEMBL2206733

CS(=O)(=O)Nc1ccc(CNF)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
KDM4E B2RXH2 1/20 0.66
ALDH1A1 P00352 1/20 0.66
LMNA P02545 1/20 0.66
HTT P42858 1/20 0.66
TRPV1 Q8NER1 1/20 0.51
NPC1 O15118 1/20 0.50
AR P10275 1/20 0.50
RAB9A P51151 1/20 0.50
KEAP1 Q14145 1/20 0.50
EPHX2 P34913 1/20 0.50
NR1H4 Q96RI1 1/20 0.50
NR3C2 P08235 1/20 0.49
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
KIF11 P52732 2/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL13538978 0.82 HPGD (0.74) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL5716360 0.81 KDM4E (0.66) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL1752455 0.81 HPGD (0.66) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL1752456 0.81 HPGD (0.66) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL6014610 0.79 HPGD (1.00) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL12054668 0.78 KEAP1 (0.75) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL10426300 0.78 KEAP1 (0.62) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL568631 0.78 KDM4E (0.61) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL179127 0.78 HPGD (0.73) HPGDSMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL518113 0.78 HPGD (0.73) HPGDSMN1; SMN2KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7981883-B2 Substituted spiro-compounds and the use thereof for producing medicaments GRUENENTHAL GMBH (DE) 2011-07-19 US disclosed
US-20090275628-A1 Substituted Spiro-Compounds And The Use Thereof For Producing Medicaments GRUENENTHAL GMBH (DE) 2009-11-05 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 (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-20090275628-A1 Substituted Spiro-Compounds And The Use Thereof For Producing Medicaments REN, PKD1, PKD2 HPGD 90/4885SMN1; SMN2 4704/4885KDM4E 3501/4885

“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.