SCHEMBL7079022

SCHEMBL7079022

Cc1nc(-c2cccc(NC3(C(=O)Nc4ccc(-c5ccccc5)c(S(N)(=O)=O)c4)CCSCC3)c2)no1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.46
TP53 P04637 5/20 0.46
POLB P06746 3/20 0.46
CA2 P00918 1/20 0.43
CHRNA7 P36544 1/20 0.39
LMNA P02545 5/20 0.39
F10 P00742 3/20 0.39
PRSS1 P07477 3/20 0.39
F2 P00734 2/20 0.39
HTR1D P28221 2/20 0.38
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR1B P28222 1/20 0.37
HTR2A P28223 1/20 0.37
PDGFRB P09619 1/20 0.37
KDR P35968 1/20 0.37

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
SCHEMBL7082187 0.94 MAPT (0.45) MAPTTP53POLBCA2CHRNA7
SCHEMBL7084211 0.93 MAPT (0.45) MAPTTP53POLBCA2CHRNA7
SCHEMBL7079028 0.92 F10 (0.47) MAPTTP53POLBCA2F10
SCHEMBL7084320 0.92 MAPT (0.44) MAPTTP53POLBCA2CHRNA7
SCHEMBL7076919 0.91 MAPT (0.43) MAPTTP53POLBCA2CHRNA7
SCHEMBL6991634 0.89 MAPT (0.42) MAPTTP53POLBCA2CHRNA7
SCHEMBL7082191 0.85 F10 (0.48) MAPTTP53POLBCA2F10
SCHEMBL7084216 0.85 F10 (0.48) MAPTTP53POLBCA2F10
SCHEMBL7084323 0.84 F10 (0.47) MAPTTP53POLBCA2F10
SCHEMBL7080917 0.83 MAPT (0.53) MAPTTP53POLBCA2LMNA

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-20030162814-A1 N-substituted 1-amino-1,1-dialkylcarboxylic acid derivatives MERCK PATENT GMBH (DE) 2003-08-28 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-20030162814-A1 N-substituted 1-amino-1,1-dialkylcarboxylic acid derivatives F5, CCNY, F2 MAPT 4873/4885TP53 3684/4885POLB 2013/4885

“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.