SCHEMBL4243114

SCHEMBL4243114

CCc1cc(NC(=O)c2ccccc2F)ccc1-c1nnc(S(=O)(=O)Cc2ccccc2)o1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 12/20 0.55
KCNH2 Q12809 11/20 0.55
PTPRC P08575 2/20 0.44
CTSL P07711 1/20 0.44
PTPN1 P18031 1/20 0.44
CTSS P25774 1/20 0.44
PTPN13 Q12923 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CHRNA1 P02708 2/20 0.43
CYP3A4 P08684 2/20 0.43
CHRNB2 P17787 2/20 0.43
CHRNA4 P43681 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL4036871 0.91 CHRNA7 (0.52) CHRNA7KCNH2PTPRCCTSLPTPN1
SCHEMBL4247033 0.88 CHRNA7 (0.54) CHRNA7KCNH2PTPRCCTSLPTPN1
SCHEMBL4242077 0.88 CHRNA7 (0.56) CHRNA7KCNH2PTPRCCTSLPTPN1
SCHEMBL13878330 0.87 CHRNA7 (0.55) CHRNA7KCNH2PTPRCCTSLPTPN1
SCHEMBL4241242 0.84 CHRNA7 (0.53) CHRNA7KCNH2MEN1KMT2AKDM4E
SCHEMBL4246981 0.81 CHRNA7 (0.51) CHRNA7KCNH2NPC1RAB9AKDM4E
SCHEMBL4246365 0.81 CHRNA7 (0.55) CHRNA7KCNH2NPC1RAB9AMEN1
SCHEMBL13878322 0.81 CHRNA7 (0.61) CHRNA7KCNH2PTPRCCTSLPTPN1
SCHEMBL4249280 0.76 IMPDH2 (0.51) CHRNA7KCNH2MEN1KMT2AKDM4E
SCHEMBL4250780 0.76 RAB9A (0.47) NPC1RAB9AMEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
US-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 US disclosed
WO-2007138033-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2007-12-06 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-20090105217-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS CHRNA7, CHRNA5, CHRNA2 CHRNA7 1/4885KCNH2 815/4885PTPRC 1955/4885

“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.