SCHEMBL3662720

SCHEMBL3662720

O=C(O)N1CCN(c2ccc(N3CCN(S(=O)(=O)C4CCCC4)CC3)cn2)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 16/20 0.65
HSD11B2 P80365 1/20 0.44
GPR119 Q8TDV5 1/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CHRM4 P08173 1/20 0.38
POLB P06746 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL3661380 0.98 HSD11B1 (0.65) HSD11B1HSD11B2GPR119MEN1KMT2A
SCHEMBL3663716 0.96 HSD11B1 (0.69) HSD11B1HSD11B2POLBTHRB
SCHEMBL3662288 0.88 HSD11B1 (0.59) HSD11B1GPR119MEN1KMT2A
SCHEMBL16215953 0.87 HSD11B1 (0.64) HSD11B1HSD11B2
SCHEMBL3664472 0.86 HSD11B1 (0.63) HSD11B1HSD11B2MEN1KMT2A
SCHEMBL3659681 0.85 HSD11B1 (0.62) HSD11B1HSD11B2KMT2A
SCHEMBL3664565 0.85 HSD11B1 (0.62) HSD11B1HSD11B2GPR119KMT2A
SCHEMBL9982741 0.84 HSD11B1 (0.48) HSD11B1MEN1KMT2A
SCHEMBL3662812 0.83 HSD11B1 (0.60) HSD11B1HSD11B2MEN1KMT2APOLB
SCHEMBL3662702 0.83 HSD11B1 (0.60) HSD11B1HSD11B2GPR119POLBTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2238126-B1 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI SA (FR) 2014-11-05 EP claimed
US-8211892-B2 Tetrahydroquinoxaline urea derivatives SANOFI-AVENTIS (FR) 2012-07-03 US claimed
EP-2238126-A2 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF Sanofi-Aventis (FR) 2010-10-13 EP claimed
WO-2009112691-A2 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-09-17 WO claimed
EP-2238126-B1 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI SA (FR) 2014-11-05 EP disclosed
US-8211892-B2 Tetrahydroquinoxaline urea derivatives SANOFI-AVENTIS (FR) 2012-07-03 US disclosed
EP-2238126-A2 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF Sanofi-Aventis (FR) 2010-10-13 EP disclosed
WO-2009112691-A2 DERIVATIVES OF TETRAHYDROQUINOXALINE UREA, PREPARATION THEREOF AND THERAPEUTIC APPLICATION THEREOF SANOFI-AVENTIS (FR) 2009-09-17 WO disclosed