SCHEMBL961743

SCHEMBL961743

CCCC[C@H](C)C[C@H](O)C=C[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 2/20 0.55
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ GALR3 O60755 1/20 0.53
▸ PTGER2 P43116 7/20 0.52
▸ PTGER4 P35408 7/20 0.52
▸ PTGER3 P43115 5/20 0.52
▸ NR4A2 P43354 3/20 0.51
▸ TSHR P16473 2/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ ABCC3 O15438 1/20 0.51
▸ ABCC4 O15439 1/20 0.51
▸ RARB P10826 1/20 0.51
▸ RARG P13631 1/20 0.51
▸ DRD1 P21728 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ HIF1A Q16665 1/20 0.51

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
SCHEMBL962042 1.00 PTGIR (0.55) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL3747302 1.00 PTGIR (0.55) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11722144 0.91 MEN1 (0.62) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11723081 0.91 MEN1 (0.62) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11727227 0.91 MEN1 (0.62) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11723075 0.91 MEN1 (0.62) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11722150 0.91 MEN1 (0.62) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11727235 0.91 MEN1 (0.62) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11719594 0.87 MEN1 (0.66) PTGIRMEN1KMT2AGALR3PTGER2
SCHEMBL11721670 0.87 MEN1 (0.66) PTGIRMEN1KMT2AGALR3PTGER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501793-B2 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2013-08-06 — — US disclosed
US-20110015238-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES ONO PHARMACEUTICAL CO., LTD. (JP) 2011-01-20 — — US disclosed
US-7833995-B2 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2010-11-16 — — US disclosed
US-20070129327-A1 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2007-06-07 — — US disclosed
EP-1707208-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES ONO PHARMACEUTICAL CO., LTD. (JP) 2006-10-04 — — EP 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-20070129327-A1 Blood flow promoters for cauda equina tissues PTGFR, PTGIS, PTGIR PTGIR 3/4885MEN1 4761/4885KMT2A 1776/4885
US-20110015238-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES PTGFR, PTGIS, PTGIR PTGIR 3/4885MEN1 4761/4885KMT2A 1776/4885

“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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