SCHEMBL31620814

SCHEMBL31620814

O=C(Cl)OCOC(=O)N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 1/20 0.40
HSD11B1 P28845 1/20 0.38
TSHR P16473 3/20 0.37
ATM Q13315 2/20 0.35
THRB P10828 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 2/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL26131514 0.78 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2HTTHSD11B1
SCHEMBL28109077 0.77 TSHR (0.42) ALDH1A1POLBSMN1; SMN2HTTTSHR
SCHEMBL2911286 0.76 ALDH1A1 (0.48) ALDH1A1POLBSMN1; SMN2HTTHSD11B1
SCHEMBL11559149 0.75 ALDH1A1 (0.43) ALDH1A1POLBSMN1; SMN2HTTHSD11B1
SCHEMBL17093002 0.75 SMN1; SMN2 (0.46) ALDH1A1POLBSMN1; SMN2HTTHSD11B1
SCHEMBL26129358 0.75 ALDH1A1 (0.40) ALDH1A1POLBSMN1; SMN2HTTHSD11B1
SCHEMBL2911537 0.74 ALDH1A1 (0.47) ALDH1A1POLBSMN1; SMN2HTTHSD11B1
SCHEMBL17803881 0.74 ALDH1A1 (0.47) ALDH1A1POLBSMN1; SMN2HTTHSD11B1
SCHEMBL10249594 0.74
SCHEMBL28921493 0.73 ALDH1A1 (0.37) ALDH1A1POLBSMN1; SMN2HTTHSD11B1

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
CN-115151553-B Boric acid derivatives 首药控股(北京)股份有限公司 2025-06-13 CN disclosed