SCHEMBL17358264

SCHEMBL17358264

C=C(C)C(=O)OC(CCCCCCC)C(O)CCCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.49
PTPN1 P18031 1/20 0.47
ABCB1 P08183 1/20 0.41
GPR84 Q9NQS5 7/20 0.41
SPHK1 Q9NYA1 2/20 0.41
FFAR1 O14842 1/20 0.41
FAAH O00519 1/20 0.39
CYP2D6 P10635 2/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
THPO P40225 1/20 0.39
MTOR P42345 1/20 0.39
BLM P54132 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TP53 P04637 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39
CETP P11597 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
SCHEMBL17358263 0.94 TSHR (0.44) TSHRPTPN1ABCB1GPR84SPHK1
SCHEMBL17358273 0.92 FFAR4 (0.53) TSHRPTPN1GPR84FFAR1MAPT
SCHEMBL17358266 0.90 TSHR (0.55) TSHRGPR84FFAR1FAAHLMNA
SCHEMBL13468872 0.89 TSHR (0.42) TSHRPTPN1ABCB1GPR84FFAR1
SCHEMBL9305316 0.87 TSHR (0.49) TSHRABCB1GPR84FFAR1FAAH
SCHEMBL27581344 0.87 TSHR (0.49) TSHRABCB1GPR84FFAR1FAAH
SCHEMBL17358271 0.87 FFAR4 (0.48) TSHRPTPN1GPR84FFAR1
SCHEMBL17358265 0.87 TSHR (0.43) TSHRPTPN1ABCB1GPR84FFAR1
SCHEMBL17358268 0.85 TSHR (0.50) TSHRGPR84FFAR1FAAHLMNA
SCHEMBL7916049 0.85 TSHR (0.46) TSHRABCB1GPR84FFAR1FAAH

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-9834626-B2 Plant oil-based materials NDSU RESEARCH FOUNDATION (US) 2017-12-05 US disclosed
US-9834626-B2 Plant oil-based materials NDSU RESEARCH FOUNDATION (US) 2017-12-05 US disclosed
US-20150368378-A1 PLANT OIL-BASED MATERIALS NDSU RESEARCH FOUNDATION (US) 2015-12-24 US disclosed
US-20150368378-A1 PLANT OIL-BASED MATERIALS NDSU RESEARCH FOUNDATION (US) 2015-12-24 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-20150368378-A1 PLANT OIL-BASED MATERIALS FASN, LIPC, PNLIP TSHR 2917/4885PTPN1 4592/4885ABCB1 3591/4885

“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.