SCHEMBL4101672

SCHEMBL4101672

CCOP(=O)(COC(=O)Cl)OCC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
PPARD Q03181 2/20 0.45
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
ALDH1A1 P00352 3/20 0.33
MAPT P10636 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
HTT P42858 1/20 0.32
MAPK1 P28482 1/20 0.32
ALOX15 P16050 1/20 0.31

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
SCHEMBL15438142 0.82 TSHR (0.50) TSHRPPARDTP53TDP1CA12
SCHEMBL8764430 0.80 ALDH1A1 (0.50) TSHRPPARDTP53TDP1CA12
SCHEMBL15438473 0.78 ALDH1A1 (0.56) TSHRPPARDTP53TDP1CA12
SCHEMBL15438320 0.78 TSHR (0.46) TSHRPPARDTP53TDP1CA12
SCHEMBL15438226 0.78 TSHR (0.46) TSHRPPARDTP53TDP1ALDH1A1
SCHEMBL11663536 0.78 TSHR (0.58) TSHRPPARDTP53TDP1CA12
SCHEMBL15438833 0.77 TSHR (0.44) TSHRPPARDTP53TDP1CA12
SCHEMBL15439927 0.77 TSHR (0.44) TSHRPPARDTP53TDP1CA12
SCHEMBL7709958 0.76 TSHR (0.40) TSHRPPARDTP53TDP1CA12
SCHEMBL15438312 0.75 TSHR (0.43) TSHRPPARDALDH1A1LMNA

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
US-4077964-A FLAME RETARDANTS FOR POLYURETHANE FOAMS SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1978-03-07 US claimed
US-20090131372-A1 PHOSPHONATE ANALOGS FOR TREATING METABOLIC DISEASES CHEN JAMES M 2009-05-21 US disclosed
US-7407965-B2 Phosphonate analogs for treating metabolic diseases GILEAD SCIENCES, INC. (US) 2008-08-05 US disclosed
US-20050227947-A1 Phosphonate analogs for treating metabolic diseases GILEAD SCIENCES, INC. 2005-10-13 US disclosed
WO-2004096237-A2 PHOSPHONATE ANALOGS FOR TREATING METABOLIC DISEASES GILEAD SCIENCES, INC. (US) 2004-11-11 WO disclosed
US-4113671-A Carbamate-phosphonates as flame-proofing agents in polyurethane foam SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1978-09-12 US disclosed
US-4113671-A Carbamate-phosphonates as flame-proofing agents in polyurethane foam SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1978-09-12 US disclosed
US-4077964-A FLAME RETARDANTS FOR POLYURETHANE FOAMS SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1978-03-07 US disclosed
US-4077964-A FLAME RETARDANTS FOR POLYURETHANE FOAMS SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) 1978-03-07 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 (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-20050227947-A1 Phosphonate analogs for treating metabolic diseases PHOSPHO1, G6PC1, PC TSHR 2537/4885PPARD 334/4885TP53 2042/4885
US-20090131372-A1 PHOSPHONATE ANALOGS FOR TREATING METABOLIC DISEASES PHOSPHO1, G6PC1, PC TSHR 2537/4885PPARD 334/4885TP53 2042/4885

“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.