SCHEMBL4249795

SCHEMBL4249795

O=C(Nc1ccc(-c2nnc(S(=O)(=O)Cc3ccccc3)o2)cc1)C1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
HSD17B10 Q99714 2/20 0.57
USP2 O75604 1/20 0.57
POLB P06746 1/20 0.57
TSHR P16473 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
CHRNA7 P36544 4/20 0.50
KCNH2 Q12809 4/20 0.50
KDM4E B2RXH2 2/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPK1 P28482 1/20 0.49
PTPN1 P18031 1/20 0.49
ENPP3 O14638 3/20 0.46
ENPP1 P22413 3/20 0.46
ENPP2 Q13822 2/20 0.46
MAPT P10636 1/20 0.44

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
SCHEMBL4242075 0.85 HPGD (0.49) HPGDSMN1; SMN2HSD17B10USP2POLB
SCHEMBL4238834 0.85 HPGD (0.49) HPGDSMN1; SMN2HSD17B10USP2POLB
SCHEMBL4246429 0.83 CYP19A1 (0.48) HPGDSMN1; SMN2HSD17B10USP2POLB
SCHEMBL4246246 0.83 HPGD (0.47) HPGDSMN1; SMN2HSD17B10USP2POLB
SCHEMBL24474024 0.81 HPGD (0.77) HPGDSMN1; SMN2HSD17B10USP2POLB
SCHEMBL4242232 0.81 ALDH1A1 (0.52) HPGDSMN1; SMN2HSD17B10USP2POLB
SCHEMBL4241857 0.79 HPGD (0.58) HPGDSMN1; SMN2HSD17B10USP2POLB
SCHEMBL4241242 0.77 CHRNA7 (0.53) L3MBTL1CHRNA7KCNH2KDM4EMEN1
SCHEMBL16157128 0.76 HPGD (0.65) HPGDSMN1; SMN2POLBTSHRKDM4E
SCHEMBL14370007 0.75 PTPN1 (0.62) HPGDSMN1; SMN2HSD17B10USP2POLB

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 HPGD 1075/4885SMN1; SMN2 1002/4885HSD17B10 1668/4885

“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.