SCHEMBL8609740

SCHEMBL8609740

CCO[C@]1(C)OC(=O)C[C@@H](C)O1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5708446 1.00 ALDH1A1 (0.34) ALDH1A1LMNASMN1; SMN2
SCHEMBL29265283 0.80 SMN1; SMN2 (0.37) ALDH1A1LMNASMN1; SMN2
SCHEMBL7053769 0.74 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL8974251 0.71 SMN1; SMN2 (0.42) ALDH1A1LMNASMN1; SMN2
SCHEMBL30812624 0.68 ALDH1A1 (0.39) ALDH1A1LMNA
SCHEMBL10355531 0.67 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL11135928 0.64
SCHEMBL7992810 0.62 LMNA (0.40) ALDH1A1LMNASMN1; SMN2
SCHEMBL3954537 0.62 ALDH1A1 (0.30) ALDH1A1SMN1; SMN2
SCHEMBL14159710 0.61 TSHR (0.43) ALDH1A1LMNA

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
EP-0528527-B1 Conjugates ZENECA LTD (GB) 1998-04-08 EP disclosed
EP-0528527-A2 Conjugates ZENECA LIMITED (GB) 1993-02-24 EP disclosed