SCHEMBL16178137

SCHEMBL16178137

O=C(O)N(c1cscn1)c1nccs1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.33
KDM4A O75164 1/20 0.32
KDM4B O94953 1/20 0.32
KDM5C P41229 1/20 0.32
KDM5B Q9UGL1 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
FFAR2 O15552 1/20 0.32
HDAC1 Q13547 2/20 0.31
KDM4C Q9H3R0 1/20 0.30

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
SCHEMBL16178136 0.81 KDM4E (0.47) KDM4EALDH1A1KDM4AKDM4BKDM5C
SCHEMBL16180417 0.81 LMNA (0.43) LMNAALDH1A1TRPM8FFAR2HDAC1
SCHEMBL12234339 0.72 NPSR1 (0.44) KDM4EALDH1A1KDM4AKDM4BKDM5C
SCHEMBL1896858 0.72 LMNA (0.53) LMNAALDH1A1TRPM8HDAC1
SCHEMBL28216648 0.72 LMNA (0.39) LMNAKDM4EALDH1A1TRPM8FFAR2
SCHEMBL9834300 0.70 ALDH1A1 (0.42) LMNAALDH1A1TRPM8FFAR2HDAC1
SCHEMBL18421152 0.69 LMNA (0.44) LMNAKDM4EALDH1A1TRPM8FFAR2
SCHEMBL11482412 0.69 ALDH1A1 (0.41) LMNAALDH1A1TRPM8FFAR2HDAC1
SCHEMBL2936251 0.67 FFAR2 (0.49) LMNAALDH1A1TRPM8FFAR2
SCHEMBL27572710 0.67 KDM4E (0.44) KDM4EALDH1A1KDM4AKDM4BKDM5C

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
WO-2014170793-A1 SULFONAMIDES FOR THE TREATMENT OF GOUT PFIZER LIMITED (GB) 2014-10-23 WO disclosed
US-20140315933-A1 CHEMICAL COMPOUNDS PFIZER LIMITED (GB) 2014-10-23 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-20140315933-A1 CHEMICAL COMPOUNDS SULT2A1, SULT1A1, SULT1E1 LMNA 4410/4885KDM4E 3595/4885ALDH1A1 51/4885

“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.