SCHEMBL11470993

SCHEMBL11470993

O=C(Cl)C(=O)c1ccc(O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT1B Q92523 1/20 0.61
CES2 O00748 2/20 0.58
ESR1 P03372 1/20 0.55
ESR2 Q92731 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
PKM P14618 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
CA12 O43570 2/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52
CA14 Q9ULX7 2/20 0.52
CA3 P07451 1/20 0.52
TYR P14679 1/20 0.52
DRD1 P21728 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52

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
SCHEMBL181662 0.83 CES2 (0.79) CPT1BCES2ESR1ESR2LMNA
SCHEMBL5917993 0.79 CES2 (0.75) CES2LMNAMAPTHPGDHTT
SCHEMBL1454951 0.78 LMNA (0.60) CPT1BCES2ESR1ESR2LMNA
Hydroquinone SCHEMBL7948998 0.78 LMNA (0.60) CPT1BCES2ESR1ESR2LMNA
SCHEMBL7532519 0.77 MAPT (0.52) CPT1BCES2ESR1ESR2LMNA
SCHEMBL6522491 0.77 CES2 (0.71) CES2MAPTCA1CA2MEN1
SCHEMBL11718383 0.77 CES2 (0.71) CES2LMNAMAPTHPGDHTT
SCHEMBL8386482 0.77 CES2 (0.71) CES2MAPTCA1CA2MEN1
SCHEMBL5918066 0.77 CES2 (0.71) CES2LMNAMAPTPKMHPGD
SCHEMBL204420 0.77 CPT1B (0.52) CPT1BCES2ESR1ESR2LMNA

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-4207234-A 4-Unsubstituted azetidinone derivatives and process for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-06-10 US disclosed