SCHEMBL8915515

SCHEMBL8915515

C#CCN1CC(=O)N(c2cc(Cl)ccc2C)C1=S

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 14/20 0.59
MEN1 O00255 13/20 0.59
GAA P10253 2/20 0.41
LMNA P02545 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 1/20 0.41
HCRTR1 O43613 1/20 0.40
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL8919380 0.90 KMT2A (0.48) KMT2AMEN1GAALMNASMN1; SMN2
SCHEMBL8716448 0.85 KMT2A (0.64) KMT2AMEN1GAALMNASMN1; SMN2
SCHEMBL8711149 0.81 KMT2A (0.59) KMT2AMEN1GAALMNASMN1; SMN2
SCHEMBL8663215 0.81 KMT2A (0.59) KMT2AMEN1GAALMNASMN1; SMN2
SCHEMBL8661948 0.78 MEN1 (0.55) KMT2AMEN1ALDH1A1POLB
SCHEMBL6097864 0.78 MEN1 (0.40) KMT2AMEN1LMNAMAPTALDH1A1
SCHEMBL8915225 0.76 KMT2A (0.64) KMT2AMEN1GAALMNASMN1; SMN2
SCHEMBL8585347 0.75 KMT2A (0.53) KMT2AMEN1GAAALDH1A1HTT
SCHEMBL8664720 0.74 MEN1 (0.52) KMT2AMEN1GAAALDH1A1
SCHEMBL8711085 0.73 KMT2A (0.51) KMT2AMEN1GAAMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5663363-A 2-thioxo-imidazolidin-4-one derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1997-09-02 US claimed
US-5554607-A INCREASING HDL CHOLESTEROL AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-10 US claimed
US-5663363-A 2-thioxo-imidazolidin-4-one derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1997-09-02 US disclosed
US-5554607-A INCREASING HDL CHOLESTEROL AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-10 US disclosed