SCHEMBL9319545

SCHEMBL9319545

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 7/20 0.35
▸ PTGER4 P35408 4/20 0.35
▸ TSHR P16473 3/20 0.35
▸ PTGER2 P43116 3/20 0.35
▸ HPGD P15428 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ABCC3 O15438 1/20 0.35
▸ ABCC4 O15439 1/20 0.35
▸ RARB P10826 1/20 0.35
▸ RARG P13631 1/20 0.35
▸ DRD1 P21728 1/20 0.35
▸ NR4A2 P43354 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ PTGER3 P43115 2/20 0.34
▸ NR1I2 O75469 1/20 0.34

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
SCHEMBL9318025 1.00 PTGIR (0.35) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL9318033 1.00 PTGIR (0.35) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL9703199 0.89 PTGIR (0.33) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL9703201 0.89 PTGIR (0.33) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL10964047 0.88 PTGIR (0.37) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL10963649 0.88 PTGIR (0.37) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL10963646 0.88 PTGIR (0.37) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL10964037 0.88 PTGIR (0.37) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL10965448 0.87 PTGIR (0.38) PTGIRPTGER4TSHRPTGER2HPGD
SCHEMBL10965451 0.87 PTGIR (0.38) PTGIRPTGER4TSHRPTGER2HPGD

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-5329035-A Biosynthesis of prostaglandins TEIJIN LIMITED (JP) 1994-07-12 — — US disclosed
EP-0178139-A2 Process for producing 2,3-disubstituted -4-substituted cyclopentanones, enantiomorphs, or mixtures thereof TEIJIN LIMITED (JP) 1986-04-16 — — EP disclosed
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