SCHEMBL17238209

SCHEMBL17238209

CCC=CCC=CCC=CCCCCCCC[C@@H](O)C[C@@H](O)CC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.56
▸ CYP19A1 P11511 4/20 0.56
▸ F7 P08709 3/20 0.56
▸ F3 P13726 3/20 0.56
▸ MAPT P10636 3/20 0.56
▸ OXER1 Q8TDS5 3/20 0.56
▸ PPARG P37231 3/20 0.56
▸ FFAR1 O14842 3/20 0.56
▸ PTGS1 P23219 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ PPARD Q03181 2/20 0.56
▸ PPARA Q07869 2/20 0.56
▸ FFAR4 Q5NUL3 2/20 0.56
▸ CYP3A4 P08684 2/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ NR1I2 O75469 1/20 0.56

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
SCHEMBL17238207 1.00 ALDH1A1 (0.56) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL17238221 0.94 ALDH1A1 (0.54) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL17238219 0.94 ALDH1A1 (0.54) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL8606252 0.93 ALDH1A1 (0.61) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL6329060 0.88 GPR84 (0.62) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL6329058 0.88 GPR84 (0.62) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL9457075 0.84 GPR84 (0.72) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL9457081 0.84 GPR84 (0.72) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL8604202 0.84 GPR84 (0.72) ALDH1A1CYP19A1F7F3MAPT
SCHEMBL28437422 0.84 GPR84 (0.62) ALDH1A1CYP19A1F7F3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9540307-B2 Statins of omega-3 polyunsaturated acids for treating hypercholesterolemia JIVA PHARMA, INC. (US) 2017-01-10 — — US disclosed
US-20150322032-A1 Statins of Omega-3 Polyunsaturated Acids for Treating Hypercholesterolemia JIVA PHARMA, INC. (US) 2015-11-12 — — 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-20150322032-A1 Statins of Omega-3 Polyunsaturated Acids for Treating Hypercholesterolemia HMGCR, ELOVL3, STARD3 ALDH1A1 3793/4885CYP19A1 1014/4885F7 3615/4885

“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.

Send feedback