SCHEMBL17131978

SCHEMBL17131978

O=P1(COCCO)OCCCO1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL8762721 0.71
SCHEMBL13867095 0.68
Tetraethylene Glycol SCHEMBL618122 0.68 MEN1 (0.65) TSHRMAPK1MEN1KMT2AALDH1A1
Pentaethylene Glycol SCHEMBL7131185 0.68 MEN1 (0.65) TSHRMAPK1MEN1KMT2AALDH1A1
Triethylene Glycol SCHEMBL617399 0.68 MEN1 (0.65) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL17131985 0.66
SCHEMBL17949131 0.64 MEN1 (0.44) TSHRMAPK1MEN1KMT2AALDH1A1
Di(Hydroxyethyl)Ether SCHEMBL5009910 0.62 TSHR (0.67) TSHRMAPK1MEN1KMT2AALDH1A1
SCHEMBL9653479 0.61
Di(Hydroxyethyl)Ether SCHEMBL5961692 0.61 TSHR (0.56) TSHRMAPK1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9738766-B2 Organophosphorus compounds for flame retardant polyurethane foams DOW GLOBAL TECHNOLOGIES LLC (US) 2017-08-22 US disclosed
US-9738766-B2 Organophosphorus compounds for flame retardant polyurethane foams DOW GLOBAL TECHNOLOGIES LLC (US) 2017-08-22 US disclosed
US-20150274915-A1 ORGANOPHOSPHORUS COMPOUNDS FOR FLAME RETARDANT POLYURETHANE FOAMS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-10-01 US disclosed
US-20150274915-A1 ORGANOPHOSPHORUS COMPOUNDS FOR FLAME RETARDANT POLYURETHANE FOAMS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-10-01 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-20150274915-A1 ORGANOPHOSPHORUS COMPOUNDS FOR FLAME RETARDANT POLYURETHANE FOAMS PFAS, FGR, FFAR3 TSHR 267/4885MAPK1 4453/4885MEN1 3632/4885

“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.