SCHEMBL8665382

SCHEMBL8665382

CC1(NC(=O)C(=O)O)CCc2cc(Cl)ccc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 6/20 0.43
SRD5A2 P31213 4/20 0.43
DGAT1 O75907 7/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
DRD2 P14416 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
SDCBP O00560 1/20 0.36
SDC2 P34741 1/20 0.36
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HTT P42858 1/20 0.35
FABP4 P15090 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
SCHEMBL9600587 0.88 SMN1; SMN2 (0.44) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL9600590 0.74 SRD5A1 (0.43) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL9587877 0.74 HTR2A (0.46) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL8936189 0.73 DRD2 (0.45) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
Hydrochloric Acid SCHEMBL8665861 0.72 DRD2 (0.44) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL8936183 0.72 DRD2 (0.47) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL8936164 0.69 SMN1; SMN2 (0.41) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL8667725 0.68 SMN1; SMN2 (0.43) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL8667719 0.68 SMN1; SMN2 (0.43) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2
SCHEMBL8667717 0.68 SMN1; SMN2 (0.43) SRD5A1SRD5A2DGAT1SMN1; SMN2DRD2

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-0632803-B1 ARTHROPODICIDAL AMIDES DU PONT (US) 1998-12-09 EP disclosed