SCHEMBL6034804

SCHEMBL6034804

Cc1c(CNCCCNc2nc3cscc3[nH]2)sc(C(F)(F)F)c1Br

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.36
RIPK1 Q13546 1/20 0.36
BCHE P06276 1/20 0.32
TRPC3 Q13507 1/20 0.32
TRPC4 Q9UBN4 1/20 0.32
TRPC5 Q9UL62 1/20 0.32

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
Hydrochloric Acid SCHEMBL5379165 0.99 SLC2A1 (0.35) SLC2A1RIPK1BCHETRPC3TRPC4
SCHEMBL5379953 0.87 SLC2A1 (0.39) SLC2A1BCHETRPC3TRPC4TRPC5
SCHEMBL6034488 0.85 SLC2A1 (0.36) SLC2A1RIPK1BCHETRPC3TRPC4
Hydrochloric Acid SCHEMBL5373961 0.84 SLC2A1 (0.35) SLC2A1BCHETRPC3TRPC4TRPC5
Hydrochloric Acid SCHEMBL5395652 0.83 SLC2A1 (0.38) SLC2A1RIPK1BCHETRPC3TRPC4
SCHEMBL5376553 0.83 SLC2A1 (0.36) SLC2A1BCHETRPC3TRPC4TRPC5
SCHEMBL5384788 0.83 SLC2A1 (0.36) SLC2A1BCHETRPC3TRPC4TRPC5
Hydrochloric Acid SCHEMBL5389253 0.80 SLC2A1 (0.47) SLC2A1RIPK1
Hydrochloric Acid SCHEMBL5376540 0.80 SLC2A1 (0.35) SLC2A1RIPK1
SCHEMBL5379063 0.74 BCHE (0.33) SLC2A1BCHETRPC3TRPC4TRPC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060128735-A1 Substituted thiophenes with antibacterial activity REPLIDYNE, INC. (US) 2006-06-15 US disclosed
US-7030137-B2 Substituted thiophenes with antibacterial activity REPLIDYNE, INC. (US) 2006-04-18 US disclosed
US-20050009833-A1 Substituted thiophenes with antibacterial activity REPLIDYNE, INC. 2005-01-13 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 (2 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-20050009833-A1 Substituted thiophenes with antibacterial activity TST, MTR, NSUN3 SLC2A1 2761/4885RIPK1 3541/4885BCHE 1197/4885
US-20060128735-A1 Substituted thiophenes with antibacterial activity TST, MTR, NSUN3 SLC2A1 2761/4885RIPK1 3541/4885BCHE 1197/4885

“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.