SCHEMBL1774154

SCHEMBL1774154

OCCNCCCCCCCc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.81
S1PR2 O95136 1/20 0.63
S1PR4 O95977 1/20 0.63
S1PR1 P21453 1/20 0.63
S1PR3 Q99500 1/20 0.63

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
SCHEMBL27456705 0.98 SIGMAR1 (0.77) SIGMAR1S1PR2S1PR4S1PR1S1PR3
SCHEMBL8034862 0.92 SIGMAR1 (0.75) SIGMAR1
SCHEMBL7360959 0.92 SIGMAR1 (0.81) SIGMAR1S1PR2S1PR4S1PR1S1PR3
SCHEMBL7296296 0.92 SIGMAR1 (0.81) SIGMAR1S1PR2S1PR4S1PR1S1PR3
SCHEMBL3681105 0.92 SIGMAR1 (0.79) SIGMAR1
Hydrochloric Acid SCHEMBL6895156 0.90 SIGMAR1 (0.76) SIGMAR1
SCHEMBL4819795 0.90 SIGMAR1 (0.77) SIGMAR1S1PR2S1PR4S1PR1S1PR3
SCHEMBL26985759 0.90 SIGMAR1 (0.77) SIGMAR1S1PR2S1PR4S1PR1S1PR3
SCHEMBL30045011 0.90 SIGMAR1 (0.66) SIGMAR1S1PR2S1PR4S1PR1S1PR3
SCHEMBL9819830 0.90 SIGMAR1 (1.00) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2498746-B1 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES UNILEVER PLC NO 41424 (GB) 2016-08-24 EP disclosed
EP-2498746-B1 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES UNILEVER PLC NO 41424 (GB) 2016-08-24 EP disclosed
US-8309064-B2 Skin care compositions comprising phenoxyalkyl amines CONOPCO, INC. (US) 2012-11-13 US disclosed
US-8309064-B2 Skin care compositions comprising phenoxyalkyl amines CONOPCO, INC. (US) 2012-11-13 US disclosed
US-8309064-B2 Skin care compositions comprising phenoxyalkyl amines CONOPCO, INC. (US) 2012-11-13 US disclosed
WO-2011054804-A2 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES UNILEVER PLC (GB) 2011-05-12 WO disclosed
US-20110110870-A1 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES CONOPCO, INC., D/B/A UNILEVER (US) 2011-05-12 US disclosed
US-20110110870-A1 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES CONOPCO, INC., D/B/A UNILEVER (US) 2011-05-12 US disclosed
US-20110110870-A1 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES CONOPCO, INC., D/B/A UNILEVER (US) 2011-05-12 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-20110110870-A1 SKIN CARE COMPOSITIONS COMPRISING PHENOXYALKYL AMINES CUTA, TYR, FLNA SIGMAR1 2642/4885S1PR2 2188/4885S1PR4 1988/4885

“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.