SCHEMBL6094947

SCHEMBL6094947

CS(=O)(=O)CCCOc1ccc(NC(=O)c2c[nH]c3c2C(=O)CCC3)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
TP53 P04637 3/20 0.42
HTT P42858 4/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
LMNA P02545 3/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
ROCK2 O75116 1/20 0.35
ROCK1 Q13464 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL6094237 0.89 MAPT (0.41) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL5735674 0.88 MAPT (0.43) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL6092478 0.88 TP53 (0.39) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL6093068 0.86 MAPT (0.42) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL5734635 0.86 TP53 (0.41) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL6092697 0.85 MAPT (0.41) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL7392174 0.85 TP53 (0.52) MAPTTP53HTTSMN1; SMN2NPC1
SCHEMBL6096171 0.85 MAPT (0.43) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL6094108 0.84 MAPT (0.39) MAPTTP53HTTRECQLSMN1; SMN2
SCHEMBL6095405 0.84 HRH3 (0.47) MAPTTP53HTTSMN1; SMN2NPC1

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
US-7109351-B1 Fused pyrrolecarboxamides; GABA brain receptor ligands NEUROGEN CORPORATION (US) 2006-09-19 US disclosed
US-20050014939-A1 Fused pyrrolecarboxamides: GABA brain receptor ligands NEUROGEN CORPORATION 2005-01-20 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-20050014939-A1 Fused pyrrolecarboxamides: GABA brain receptor ligands GABRB2, GABRB1, GABRB3 MAPT 456/4885TP53 4107/4885HTT 1263/4885

“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.