SCHEMBL7070014

SCHEMBL7070014

Cc1nc(-c2ccc(NC(=O)N3CCN(C(=O)OC(C)(C)C)CC3)cc2)no1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.61
MAPT P10636 6/20 0.60
HDAC4 P56524 2/20 0.55
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
JAK2 O60674 1/20 0.52
JAK1 P23458 1/20 0.52
LMNA P02545 2/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
DGAT1 O75907 2/20 0.52
POLB P06746 2/20 0.50
PTPN2 P17706 1/20 0.50
PTPN1 P18031 1/20 0.50
PTPN6 P29350 1/20 0.50
NAMPT P43490 1/20 0.49
THRB P10828 1/20 0.49
ABL1 P00519 1/20 0.48
RIN1 Q13671 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL7653912 0.84 HDAC4 (0.74) GPR119HDAC4MEN1KMT2AJAK2
SCHEMBL4422414 0.84 GPR119 (0.67) GPR119MAPTHDAC4MEN1KMT2A
SCHEMBL7074329 0.81 MAPT (0.59) MAPTMEN1KMT2ALMNAHPGD
SCHEMBL7129860 0.81 GPR119 (0.61) GPR119MAPTHDAC4KMT2AJAK2
SCHEMBL7071589 0.79 GPR119 (0.59) GPR119MAPTHDAC4JAK2JAK1
SCHEMBL7648133 0.79 MAPT (0.59) MAPTLMNAHPGDHTTPOLB
SCHEMBL19970869 0.79 MAPT (0.69) GPR119MAPTMEN1KMT2ALMNA
SCHEMBL7653492 0.78 CNR1 (0.61) MAPTHDAC4NAMPT
SCHEMBL7649408 0.78 DGAT1 (0.58) MAPTHDAC4LMNADGAT1POLB
SCHEMBL7254923 0.78 GPR119 (0.57) GPR119HDAC4

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
EP-1025086-B1 BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS MERCK PATENT GMBH (DE) 2003-06-25 EP disclosed
US-6492368-B1 Benzamidine derivatives as factor XA inhibitors MERCK PATENT GMBH (DE) 2002-12-10 US disclosed