SCHEMBL11401490

SCHEMBL11401490

CCCCCC(/C=C/[C@H]1C(O[Si](C)(C)C)C[C@H]2C(=O)C[C@H]21)O[Si](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 8/20 0.33
▸ TSHR P16473 3/20 0.33
▸ PTGER4 P35408 3/20 0.33
▸ PTGER2 P43116 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ ABCC3 O15438 1/20 0.33
▸ ABCC4 O15439 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ RARG P13631 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ NR4A2 P43354 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ PTGFR P43088 2/20 0.32
▸ TBXA2R P21731 2/20 0.32

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
SCHEMBL11397393 0.86 TSHR (0.31) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11190452 0.78 TSHR (0.31) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11395668 0.76 PTGIR (0.39) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11178167 0.76 TSHR (0.31) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL9297046 0.75 — —
SCHEMBL9297044 0.75 — —
SCHEMBL11400713 0.73 PTGIR (0.46) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11398016 0.73 PTGIR (0.30) PTGIR
SCHEMBL11190603 0.73 PDE4D (0.39) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11187132 0.72 PTGIR (0.30) PTGIR

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
US-4272629-A Novel prostaglandin intermediates ALLEN & HANBURYS LIMITED (GB) 1981-06-09 — — US disclosed
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