SCHEMBL11260041

SCHEMBL11260041

CCCCC(C)(C)C(/C=C/[C@@H]1[C@@H](C/C=C\CCCC(=O)O)[C@@H](O)C[C@H]1OC1CCCCO1)OC1CCCCO1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TBXA2R P21731 6/20 0.56
▸ PTGFR P43088 6/20 0.56
▸ PTGER3 P43115 4/20 0.56
▸ PTGER1 P34995 3/20 0.56
▸ LMNA P02545 4/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ SLCO2A1 Q92959 2/20 0.49
▸ PTGER4 P35408 1/20 0.49
▸ PTGDR Q13258 1/20 0.49
▸ HPGD P15428 2/20 0.47
▸ TSHR P16473 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ PDE4D Q08499 2/20 0.46
▸ ABCC4 O15439 1/20 0.46
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ HKDC1 Q2TB90 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL11161148 1.00 TBXA2R (0.56) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL9483584 0.93 ALDH1A1 (0.51) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL10626177 0.93 ALDH1A1 (0.51) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL9483578 0.93 ALDH1A1 (0.51) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL10626179 0.93 ALDH1A1 (0.51) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL9482108 0.92 TBXA2R (0.47) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL9482104 0.92 TBXA2R (0.47) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL11733787 0.90 TBXA2R (0.57) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL10835463 0.90 PDE4D (0.46) TBXA2RPTGFRPTGER3PTGER1LMNA
SCHEMBL10657235 0.90 PDE4D (0.46) TBXA2RPTGFRPTGER3PTGER1LMNA

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-4338316-A PROSTAGLANDIN F SERIES ANALOGUES IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1982-07-06 — — US disclosed
EP-0010360-B1 PROSTANE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THEIR PHARMACEUTICAL COMPOSITIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-06-02 — — EP disclosed
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