SCHEMBL958152

SCHEMBL958152

CCCC[C@H](C)C[C@H](O)/C=C/[C@H]1C=CC(=O)[C@@H]1CCCC/C=C/C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 4/20 0.57
▸ NR4A2 P43354 3/20 0.57
▸ HPGD P15428 3/20 0.52
▸ MEN1 O00255 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ HIF1A Q16665 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ NR4A1 P22736 1/20 0.52
▸ PTPN7 P35236 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ MAPT P10636 1/20 0.43
▸ UCHL3 P15374 1/20 0.43
▸ PTGIR P43119 3/20 0.40
▸ PTGER4 P35408 3/20 0.39
▸ PTGER2 P43116 3/20 0.39
▸ PTGER3 P43115 2/20 0.39
▸ TSHR P16473 3/20 0.36
▸ MAPK1 P28482 2/20 0.36

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
SCHEMBL958153 1.00 TRPA1 (0.57) TRPA1NR4A2HPGDMEN1LMNA
SCHEMBL3734912 0.86 TRPA1 (0.77) TRPA1NR4A2HPGDMEN1LMNA
SCHEMBL10622139 0.86 TRPA1 (0.47) TRPA1NR4A2HPGDMEN1LMNA
SCHEMBL10622134 0.86 TRPA1 (0.47) TRPA1NR4A2HPGDMEN1LMNA
SCHEMBL961642 0.82 MEN1 (0.46) TRPA1NR4A2HPGDMEN1LMNA
SCHEMBL964416 0.82 MEN1 (0.46) TRPA1NR4A2HPGDMEN1LMNA
SCHEMBL961640 0.82 MEN1 (0.46) TRPA1NR4A2HPGDMEN1LMNA
Limaprost SCHEMBL24342042 0.81 PTGIR (0.59) NR4A2HPGDMEN1LMNAKMT2A
Limaprost SCHEMBL20815450 0.81 PTGIR (0.59) NR4A2HPGDMEN1LMNAKMT2A
Limaprost SCHEMBL373011 0.81 PTGIR (0.59) NR4A2HPGDMEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110015238-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES ONO PHARMACEUTICAL CO., LTD. (JP) 2011-01-20 — — US claimed
US-20070129327-A1 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2007-06-07 — — US claimed
EP-1707208-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES ONO PHARMACEUTICAL CO., LTD. (JP) 2006-10-04 — — EP claimed
CN-116583500-A Method for separating geometrical isomers 协和医药化工股份有限公司 2023-08-11 — — CN disclosed
US-8501793-B2 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2013-08-06 — — US disclosed
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-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-7833995-B2 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2010-11-16 — — 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
US-20070129327-A1 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2007-06-07 — — 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 TRPA1 2153/4885NR4A2 1212/4885HPGD 21/4885
US-20110015238-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES PTGFR, PTGIS, PTGIR TRPA1 2153/4885NR4A2 1212/4885HPGD 21/4885

“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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