SCHEMBL6326876

SCHEMBL6326876

Nc1ccc(C(=O)c2ccc(-n3cncn3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
SMYD3 Q9H7B4 1/20 0.49
DPP4 P27487 2/20 0.46
RAB9A P51151 2/20 0.45
RXFP1 Q9HBX9 1/20 0.45
ESRRA P11474 1/20 0.44
HSP90AA1 P07900 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 1/20 0.43
FBP1 P09467 1/20 0.42
GPR119 Q8TDV5 1/20 0.42
S1PR1 P21453 2/20 0.41
S1PR3 Q99500 2/20 0.41
CYP19A1 P11511 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL28755979 0.92 SMN1; SMN2 (0.59) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL118713 0.86 KDM4E (0.60) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL2905639 0.81 SMN1; SMN2 (0.56) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL327641 0.80 SMN1; SMN2 (0.58) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL6321742 0.79 L3MBTL1 (0.56) SMN1; SMN2KDM4EALDH1A1HSP90AA1MAPT
SCHEMBL3358083 0.78 KCNJ1 (0.57) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL461848 0.78 SMN1; SMN2 (0.56) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL7443020 0.75 ADH5 (0.54) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL12664197 0.74 SMN1; SMN2 (0.51) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4
SCHEMBL17321379 0.74 SMN1; SMN2 (0.51) SMN1; SMN2KDM4EALDH1A1SMYD3DPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050124664-A1 Urea thiadiazole inhibitors of plasminogen activator inhibior-1 BRISTOL-MYERS SQUIBB CO. 2005-06-09 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-20050124664-A1 Urea thiadiazole inhibitors of plasminogen activator inhibior-1 SERPINE1, SERPINC1, SERPINB1 SMN1; SMN2 3158/4885KDM4E 4669/4885ALDH1A1 155/4885

“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.