SCHEMBL5965091

SCHEMBL5965091

CCCCC(C)C[C@@H](O)C=C[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 10/20 0.78
▸ PTGER2 P43116 4/20 0.78
▸ TSHR P16473 3/20 0.78
▸ PTGER4 P35408 3/20 0.78
▸ NR4A2 P43354 3/20 0.78
▸ HPGD P15428 2/20 0.78
▸ MAPK1 P28482 2/20 0.78
▸ MEN1 O00255 1/20 0.78
▸ CYP3A4 P08684 1/20 0.78
▸ KMT2A Q03164 1/20 0.78
▸ ABCC3 O15438 1/20 0.78
▸ ABCC4 O15439 1/20 0.78
▸ RARB P10826 1/20 0.78
▸ RARG P13631 1/20 0.78
▸ DRD1 P21728 1/20 0.78
▸ LMNA P02545 1/20 0.78
▸ CYP2C19 P33261 1/20 0.78
▸ HIF1A Q16665 1/20 0.78
▸ NR1I2 O75469 1/20 0.57
▸ ESR1 P03372 1/20 0.57

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
SCHEMBL960741 1.00 PTGIR (0.78) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL23352919 1.00 PTGIR (0.78) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL960482 0.97 PTGIR (0.83) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL22489095 0.92 PTGIR (0.67) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL14263133 0.91 PTGIR (0.94) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL11673122 0.90 PTGIR (0.68) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL958202 0.89 PTGIR (0.68) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL958197 0.89 PTGIR (0.68) PTGIRPTGER2TSHRPTGER4NR4A2
SCHEMBL958200 0.89 PTGIR (0.68) PTGIRPTGER2TSHRPTGER4NR4A2
Limaprost SCHEMBL2490006 0.89 PTGIR (0.73) PTGIRPTGER2TSHRPTGER4NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1707208-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES ONO PHARMACEUTICAL CO., LTD. (JP) 2006-10-04 — — EP disclosed
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