SCHEMBL8955728

SCHEMBL8955728

OCCCCCCCCOc1cccc(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.57
KMT2A Q03164 2/20 0.57
CYP2D6 P10635 1/20 0.57
DRD2 P14416 1/20 0.55
DRD4 P21917 1/20 0.55
LMNA P02545 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
KCNH2 Q12809 1/20 0.54
KDM4E B2RXH2 2/20 0.54
WDR5 P61964 1/20 0.51

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
SCHEMBL5825855 0.93 KMT2A (0.60) HRH3KMT2ACYP2D6DRD2DRD4
SCHEMBL2096611 0.87 KMT2A (0.62) HRH3KMT2ACYP2D6DRD2DRD4
SCHEMBL8928364 0.87 PRSS1 (0.55)
SCHEMBL8928374 0.85 PRSS1 (0.53)
SCHEMBL9774806 0.83 DRD2 (0.60) HRH3KMT2ACYP2D6DRD2DRD4
SCHEMBL9808215 0.82 LMNA (0.67) HRH3KMT2ACYP2D6DRD2DRD4
SCHEMBL10632624 0.82 HRH3 (0.57) HRH3KMT2ADRD2DRD4LMNA
SCHEMBL8778541 0.82 HRH3 (0.57) HRH3KMT2ADRD2DRD4LMNA
SCHEMBL28540629 0.82 HRH3 (0.57) HRH3KMT2ADRD2DRD4LMNA
SCHEMBL8035908 0.82 HRH3 (0.57) HRH3KMT2ADRD2DRD4LMNA

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
US-5516767-A PRODRUG AS HYPOGLYCEMIC AGENT SANDOZ LTD. (CH) 1996-05-14 US disclosed
US-5412137-A Hypoglycemic agents SANDOZ LTD. (CH) 1995-05-02 US disclosed