SCHEMBL11035130

SCHEMBL11035130

COC[C@H]1CC[C@H](C2CCC(C(=O)Oc3cccc(F)c3)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 9/20 0.43
▸ POLB P06746 1/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ PTGDR Q13258 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ PTGER4 P35408 1/20 0.38
▸ PTGER3 P43115 1/20 0.38
▸ PTGER2 P43116 1/20 0.38

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
SCHEMBL11035131 1.00 PTGIR (0.43) PTGIRPOLBKMT2APTGDRL3MBTL1
SCHEMBL11035132 1.00 PTGIR (0.43) PTGIRPOLBKMT2APTGDRL3MBTL1
SCHEMBL11261292 0.86 POLB (0.43) POLBKMT2AL3MBTL1
SCHEMBL11037037 0.85 KMT2A (0.46) PTGIRKMT2APTGDR
SCHEMBL10091197 0.84 POLB (0.48) POLBKMT2AL3MBTL1
SCHEMBL6689211 0.83 POLB (0.58) POLBKMT2AL3MBTL1
SCHEMBL11034495 0.82 POLB (0.59) POLBKMT2AL3MBTL1
SCHEMBL11038720 0.81 HPGD (0.40) PTGIRKMT2AL3MBTL1
SCHEMBL11038717 0.81 HPGD (0.40) PTGIRKMT2AL3MBTL1
SCHEMBL11038715 0.81 HPGD (0.40) PTGIRKMT2AL3MBTL1

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
JP-59155336-A — — None — — JP disclosed
JP-S59155336-A ESTER DERIVATIVE OF M-SUBSTITUTED PHENOL CHISSO CORP 1984-09-04 — — JP disclosed
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