SCHEMBL6093433

SCHEMBL6093433

CCN(CCOc1ccc(NC(=O)c2c[nH]c3c2C(=O)CCC3)cc1)S(=O)(=O)c1ccsc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.37
HPGD P15428 3/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 4/20 0.36
ALDH1A1 P00352 3/20 0.35
TP53 P04637 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 1/20 0.35
POLB P06746 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
BRD4 O60885 2/20 0.33
MCHR1 Q99705 2/20 0.33
BRD9 Q9H8M2 1/20 0.33
KDR P35968 1/20 0.33
LMNA P02545 1/20 0.33
CNR1 P21554 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 0.86 MAPT (0.39) RAB9AHPGDHSD17B10MAPTALDH1A1
SCHEMBL6094516 0.84 MAPT (0.39) RAB9AHPGDHSD17B10MAPTALDH1A1
SCHEMBL6095646 0.81 MCHR1 (0.50) RAB9AMAPTTP53NPC1SMN1; SMN2
SCHEMBL6095405 0.80 HRH3 (0.47) RAB9AHSD17B10MAPTALDH1A1TP53
SCHEMBL5735674 0.78 MAPT (0.43) RAB9AHPGDHSD17B10MAPTALDH1A1
SCHEMBL7392174 0.77 TP53 (0.52) RAB9AHSD17B10MAPTALDH1A1TP53
SCHEMBL6094947 0.77 MAPT (0.42) RAB9AHPGDHSD17B10MAPTTP53
SCHEMBL5734635 0.76 TP53 (0.41) RAB9AMAPTALDH1A1TP53NPC1
SCHEMBL6092478 0.76 TP53 (0.39) RAB9AMAPTALDH1A1TP53NPC1
SCHEMBL6095941 0.76 MAPT (0.42) RAB9AHPGDHSD17B10MAPTALDH1A1

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 RAB9A 3322/4885HPGD 1055/4885HSD17B10 1702/4885

“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.