SCHEMBL999453

SCHEMBL999453

CCCCCCCCOC(CS(=O)(=O)O)CS(=O)(=O)O.[NaH]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.48
LPAR1 Q92633 4/20 0.45
LPAR3 Q9UBY5 4/20 0.45
LPAR2 Q9HBW0 1/20 0.41
CA1 P00915 8/20 0.41
CA2 P00918 8/20 0.41
CA9 Q16790 7/20 0.41
CA12 O43570 3/20 0.41
CA7 P43166 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA3 P07451 2/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
GLA P06280 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
EPHX2 P34913 1/20 0.40

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
SCHEMBL995955 1.00 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CA1
SCHEMBL999127 1.00 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CA1
SCHEMBL995593 1.00 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CA1
SCHEMBL995509 1.00 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CA1
SCHEMBL996196 1.00 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CA1
SCHEMBL996264 1.00 DNM1 (0.48) DNM1LPAR1LPAR3LPAR2CA1
SCHEMBL996362 0.91 CNR2 (0.47) DNM1LPAR1LPAR3LPAR2MAPK1
SCHEMBL995583 0.91 CNR2 (0.47) DNM1LPAR1LPAR3LPAR2MAPK1
SCHEMBL995956 0.91 CNR2 (0.47) DNM1LPAR1LPAR3LPAR2MAPK1
SCHEMBL996038 0.91 CNR2 (0.47) DNM1LPAR1LPAR3LPAR2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2454233-B1 SULFONATE SURFACTANTS AND METHODS FOR THEIR PREPARATION AND USE DOW GLOBAL TECHNOLOGIES LLC (US) 2015-02-25 EP disclosed
US-8304377-B2 Sulfonate surfactants and methods of preparation and use DOW GLOBAL TECHNOLOGIES LLC (US) 2012-11-06 US disclosed
EP-2454233-A2 SULFONATE SURFACTANTS AND METHODS OF PREPARATION AND USE Dow Global Technologies LLC (US) 2012-05-23 EP disclosed
US-20110015111-A1 SULFONATE SURFACTANTS AND METHODS OF PREPARATION AND USE DCOMCO, INC. 2011-01-20 US disclosed
WO-2011008570-A2 SULFONATE SURFACTANTS AND METHODS OF PREPARATION AND USE DOW GLOBAL TECHNOLOGIES, INC. (US) 2011-01-20 WO 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-20110015111-A1 SULFONATE SURFACTANTS AND METHODS OF PREPARATION AND USE STS, SRR, SGMS1 DNM1 893/4885LPAR1 69/4885LPAR3 38/4885

“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.