SCHEMBL1845790

SCHEMBL1845790

O=C(O)COC(=O)CCCCCCCCC(=O)OCC(=O)O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAM P19021 3/20 0.79
▸ DGKA P23743 1/20 0.48
▸ TSHR P16473 5/20 0.48
▸ LMNA P02545 3/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ PMP22 Q01453 1/20 0.48
▸ MAPT P10636 1/20 0.41
▸ GPR84 Q9NQS5 3/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ DNM1 Q05193 1/20 0.39
▸ PPARG P37231 3/20 0.39
▸ PPARD Q03181 3/20 0.39
▸ PPARA Q07869 3/20 0.39
▸ HDAC11 Q96DB2 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ SLC22A6 Q4U2R8 1/20 0.39
▸ SLC22A8 Q8TCC7 1/20 0.39
▸ TLR2 O60603 1/20 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
SCHEMBL27697262 1.00 PAM (0.79) PAMDGKATSHRLMNANFKB1
SCHEMBL27714306 1.00 PAM (0.79) PAMDGKATSHRLMNANFKB1
SCHEMBL1845834 0.97 PAM (0.75) PAMDGKATSHRLMNANFKB1
SCHEMBL27730313 0.95 PAM (0.73) PAMTSHRLMNANFKB1PMP22
SCHEMBL1712357 0.95 PAM (0.73) PAMTSHRLMNANFKB1PMP22
SCHEMBL10578392 0.92 PAM (0.69) PAMTSHRLMNANFKB1PMP22
SCHEMBL11956805 0.92 PAM (0.69) PAMDGKATSHRLMNANFKB1
SCHEMBL11047565 0.89 PAM (1.00) PAMDGKATSHRMAPTGPR84
SCHEMBL4725841 0.89 PAM (1.00) PAMDGKATSHRMAPTGPR84
SCHEMBL7775439 0.89 PAM (1.00) PAMDGKATSHRMAPTGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2323671-A1 AABB-POLY(DEPSIPEPTIDE) BIODEGRADABLE POLYMERS AND METHODS OF USE Medivas, LLC (US) 2011-05-25 — — EP disclosed
WO-2010019716-A1 AABB-POLY(DEPSIPEPTIDE) BIODEGRADABLE POLYMERS AND METHODS OF USE MEDIVAS, LLC (US) 2010-02-18 — — WO disclosed
US-20100040664-A1 AABB-POLY(DEPSIPEPTIDE) BIODEGRADABLE POLYMERS AND METHODS OF USE MEDIVAS, LLC (US) 2010-02-18 — — 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-20100040664-A1 AABB-POLY(DEPSIPEPTIDE) BIODEGRADABLE POLYMERS AND METHODS OF USE DNPEP, NPEPPS, APEH PAM 20/4885DGKA 1105/4885TSHR 4474/4885

“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.

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