SCHEMBL11512188

SCHEMBL11512188

CCCCCC(/C=C/C1CCC(O)C1CC(=O)O)OC1CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.34
▸ PTGFR P43088 2/20 0.34
▸ LMNA P02545 4/20 0.33
▸ HPGD P15428 3/20 0.33
▸ TSHR P16473 3/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ HIF1A Q16665 2/20 0.33
▸ PTGER4 P35408 3/20 0.32
▸ SLCO2A1 Q92959 2/20 0.32
▸ TBXA2R P21731 1/20 0.32
▸ PTGER1 P34995 1/20 0.32
▸ PTGER3 P43115 1/20 0.32
▸ PTGDR Q13258 1/20 0.32
▸ PTGIR P43119 2/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ PTGDR2 Q9Y5Y4 1/20 0.31
▸ ABCC4 O15439 2/20 0.31
▸ PTGER2 P43116 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31

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
SCHEMBL11512185 1.00 ALDH1A1 (0.34) ALDH1A1PTGFRLMNAHPGDTSHR
SCHEMBL11512271 1.00 ALDH1A1 (0.34) ALDH1A1PTGFRLMNAHPGDTSHR
SCHEMBL11531750 0.89 PTGFR (0.31) PTGFR
SCHEMBL11431471 0.84 ALDH1A1 (0.40) ALDH1A1PTGFRLMNAHPGDTSHR
SCHEMBL11776725 0.83 ALDH1A1 (0.39) ALDH1A1PTGFRLMNAHPGDTSHR
SCHEMBL11591221 0.82 MEN1 (0.39) ALDH1A1PTGFRLMNAHPGDTSHR
SCHEMBL11736544 0.82 MEN1 (0.39) ALDH1A1PTGFRLMNAHPGDTSHR
SCHEMBL11594713 0.82 MEN1 (0.39) ALDH1A1PTGFRLMNAHPGDTSHR
SCHEMBL11746902 0.81 — —
SCHEMBL11509792 0.81 MEN1 (0.42) PTGFRLMNAHPGDTSHRMAPK1

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-4144251-A PROSTAGLANDINS AMERICAN HOME PRODUCTS CORPORATION (US) 1979-03-13 — — US disclosed
US-3959263-A Prostaglandin intermediate AMERICAN HOME PRODUCTS CORPORATION (US) 1976-05-25 — — US disclosed
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