SCHEMBL6770890

SCHEMBL6770890

CCCCCCCC(N)(O)CCS(=O)(=O)O

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.44
FDPS P14324 10/20 0.43
SMPD1 P17405 4/20 0.43
CA2 P00918 3/20 0.41
GGPS1 O95749 5/20 0.40
CA1 P00915 2/20 0.39

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
Sulfuric Acid SCHEMBL5462582 0.84 FDPS (0.45) FDPSSMPD1CA2GGPS1CA1
SCHEMBL23001175 0.83 S1PR1 (0.45) S1PR1FDPSSMPD1CA2GGPS1
SCHEMBL23001184 0.83 S1PR1 (0.45) S1PR1FDPSSMPD1CA2GGPS1
SCHEMBL5391830 0.82 FDPS (0.52) FDPSSMPD1GGPS1
SCHEMBL1271337 0.82 FDPS (0.52) FDPSSMPD1GGPS1
SCHEMBL6770068 0.80 S1PR1 (0.43) S1PR1FDPSSMPD1CA2GGPS1
SCHEMBL28029657 0.79 S1PR1 (0.42) S1PR1FDPSSMPD1GGPS1
SCHEMBL8205811 0.79 GGPS1 (0.41) S1PR1FDPSSMPD1CA2GGPS1
SCHEMBL6771786 0.78 LMNA (0.39) S1PR1
SCHEMBL5154762 0.78 FDPS (0.40) S1PR1FDPSGGPS1

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-20040197293-A1 Anionic polyurethanes with elastic property L'OREAL S.A. (FR) 2004-10-07 US claimed
US-20040197293-A1 Anionic polyurethanes with elastic property L'OREAL S.A. (FR) 2004-10-07 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-20040197293-A1 Anionic polyurethanes with elastic property PUF60, PHOSPHO1, PLA2G2C S1PR1 4330/4885FDPS 2917/4885SMPD1 1987/4885

“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.