SCHEMBL6137249

SCHEMBL6137249

CCC[C@H](O)C#CCCCCCCCCCCCCC(N)=O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HMGCR P04035 4/20 0.52
▸ PTPN7 P35236 4/20 0.47
▸ SOAT1 P35610 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ FAAH O00519 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.40
▸ RECQL P46063 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL6137244 1.00 HMGCR (0.52) HMGCRPTPN7SOAT1MEN1FAAH
SCHEMBL6385811 0.93 HMGCR (0.56) HMGCRPTPN7SOAT1MEN1FAAH
SCHEMBL6385815 0.93 HMGCR (0.56) HMGCRPTPN7SOAT1MEN1FAAH
SCHEMBL6138507 0.87 HMGCR (0.68) HMGCRPTPN7MEN1KMT2AKDM4E
SCHEMBL6389166 0.87 HMGCR (0.68) HMGCRPTPN7MEN1KMT2AKDM4E
SCHEMBL6137527 0.81 HMGCR (0.48) HMGCRPTPN7MEN1CYP3A4KMT2A
SCHEMBL6137532 0.81 HMGCR (0.48) HMGCRPTPN7MEN1CYP3A4KMT2A
SCHEMBL6138656 0.81 HMGCR (0.48) HMGCRPTPN7MEN1CYP3A4KMT2A
SCHEMBL6138650 0.81 HMGCR (0.48) HMGCRPTPN7MEN1CYP3A4KMT2A
SCHEMBL6137269 0.80 HMGCR (0.73) HMGCRPTPN7MEN1KMT2AKDM4E

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-20050038259-A1 Hydroxyeicosenoic acid anaglogs TAISHO PHARMACEUTICAL CO., LTD. (JP) 2005-02-17 — — US disclosed
EP-1425258-A4 HYDROXYEICOSENOIC ACID ANALOGS TAISHO PHARMACEUTICAL CO LTD (JP) 2005-02-16 — — EP disclosed
EP-1425258-A2 HYDROXYEICOSENOIC ACID ANALOGS TAISHO PHARMACEUTICAL CO., LTD (JP) 2004-06-09 — — EP disclosed
WO-2003024390-A2 HYDROXYEICOSENOIC ACID ANALOGS TAISHO PHARMACEUTICAL CO., LTD. (JP) 2003-03-27 — — WO 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-20050038259-A1 Hydroxyeicosenoic acid anaglogs HCAR1, HRH4, HCAR3 HMGCR 226/4885PTPN7 2459/4885SOAT1 1737/4885

“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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