SCHEMBL6094516

SCHEMBL6094516

CCCS(=O)(=O)N(CC)CCOc1ccc(NC(=O)c2c[nH]c3c2C(=O)CCC3)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.39
TP53 P04637 2/20 0.39
MCHR1 Q99705 3/20 0.36
KDR P35968 2/20 0.35
HTT P42858 3/20 0.35
RECQL P46063 1/20 0.35
HSD17B10 Q99714 4/20 0.35
RAB9A P51151 4/20 0.35
KDM4E B2RXH2 2/20 0.35
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MCL1 Q07820 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 2/20 0.34
NPC1 O15118 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL6094108 0.91 MAPT (0.39) MAPTTP53MCHR1KDRHTT
SCHEMBL6093433 0.84 RAB9A (0.37) MAPTTP53MCHR1KDRHSD17B10
SCHEMBL6095405 0.84 HRH3 (0.47) MAPTTP53MCHR1KDRHTT
SCHEMBL6095646 0.83 MCHR1 (0.50) MAPTTP53MCHR1HTTRAB9A
SCHEMBL6094947 0.82 MAPT (0.42) MAPTTP53KDRHTTRECQL
SCHEMBL5735674 0.82 MAPT (0.43) MAPTTP53KDRHTTRECQL
SCHEMBL7392174 0.81 TP53 (0.52) MAPTTP53HTTHSD17B10RAB9A
SCHEMBL6095531 0.81 MAPT (0.43) MAPTTP53HTTRECQLHSD17B10
SCHEMBL5734635 0.80 TP53 (0.41) MAPTTP53KDRHTTRECQL
SCHEMBL6092478 0.80 TP53 (0.39) MAPTTP53HTTRECQLRAB9A

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 4107/4885MCHR1 200/4885

“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.