SCHEMBL10359313

SCHEMBL10359313

C[C@@]1(CCCC(=O)O)CCC(=O)[C@@H]2O[C@@H]21

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 2/20 0.34
▸ AR P10275 2/20 0.31
▸ FNTA P49354 1/20 0.31
▸ FNTB P49356 1/20 0.31
▸ IMPDH1 P20839 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ TSHR P16473 1/20 0.30

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
SCHEMBL10359236 0.91 IMPDH1 (0.36) PTGS1FNTAFNTBIMPDH1
SCHEMBL10359555 0.91 IMPDH1 (0.36) PTGS1FNTAFNTBIMPDH1
SCHEMBL10359299 0.82 TSHR (0.33) ALDH1A1TSHR
SCHEMBL10359748 0.76 PPARG (0.39) PTGS1KDM4EALDH1A1POLBMAPT
SCHEMBL2240425 0.67 CYP3A4 (0.31) —
SCHEMBL2558530 0.63 LMNA (0.46) ALDH1A1TSHR
SCHEMBL5919687 0.61 PRKCA (0.38) TSHR
SCHEMBL9754775 0.59 LMNA (0.40) ALDH1A1TSHR
SCHEMBL6138341 0.59 OPRM1 (0.41) ALDH1A1TSHR
SCHEMBL11245204 0.59 LMNA (0.40) ALDH1A1TSHR

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-0213547-B1 CYCLOHEXANEALKANOIC ACIDS MERRELL DOW PHARMACEUTICALS INC. (US) 1990-12-27 — — EP claimed
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