SCHEMBL18024971

SCHEMBL18024971

C[C@]1(O)C2CC(C2)C[C@H]1O

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 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
SCHEMBL20877606 1.00 HSD11B1 (0.30) HSD11B1
SCHEMBL40305 0.80 ALDH1A1 (0.33) HSD11B1
SCHEMBL17352397 0.80 ALDH1A1 (0.33) HSD11B1
SCHEMBL29078823 0.78 ALDH1A1 (0.32) HSD11B1
Methane SCHEMBL28789658 0.78 ALDH1A1 (0.32) HSD11B1
Bromide SCHEMBL7549895 0.78 ALDH1A1 (0.32) HSD11B1
Bromide SCHEMBL7549893 0.76 ALDH1A1 (0.31) HSD11B1
SCHEMBL21425589 0.73
SCHEMBL14153924 0.69 LMNA (0.32)
SCHEMBL27457352 0.67

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
US-9421237-B2 Tripeptide boronic acid or boronic ester, preparative method and use thereof PEKING UNIVERSITY (CN) 2016-08-23 US disclosed