SCHEMBL10788877

SCHEMBL10788877

Nc1cccc(C(=O)Nn2cnnn2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4C Q9H3R0 1/20 0.43
TSHR P16473 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PBRM1 Q86U86 1/20 0.41
LMNA P02545 2/20 0.41
PTGS1 P23219 2/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 2/20 0.40
NPC1 O15118 1/20 0.40
MITF O75030 1/20 0.40
ULK1 O75385 1/20 0.40
KAT6A Q92794 1/20 0.40
EPHX2 P34913 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL3668615 0.82 SMN1; SMN2 (0.52) SMN1; SMN2HSD17B10KDM4EALDH1A1TSHR
SCHEMBL10936307 0.75 TSHR (0.53) NPSR1HSD17B10KDM4EALDH1A1TSHR
SCHEMBL9921285 0.70 SMN1; SMN2 (0.59) SMN1; SMN2NPSR1HSD17B10KDM4EALDH1A1
SCHEMBL6163277 0.70 NPC1 (0.52) SMN1; SMN2HSD17B10KDM4EALDH1A1MEN1
SCHEMBL7697402 0.70 HTT (0.58) SMN1; SMN2NPSR1HSD17B10KDM4EALDH1A1
SCHEMBL6999270 0.70 PBRM1 (0.58) SMN1; SMN2NPSR1HSD17B10KDM4EALDH1A1
SCHEMBL31035124 0.69 KDM4E (0.66) SMN1; SMN2NPSR1HSD17B10KDM4EALDH1A1
SCHEMBL294944 0.69 KDM4E (0.66) SMN1; SMN2NPSR1HSD17B10KDM4EALDH1A1
SCHEMBL6159659 0.69 KDM4E (0.62) SMN1; SMN2NPSR1HSD17B10KDM4EALDH1A1
SCHEMBL13168478 0.68 SMN1; SMN2 (0.56) SMN1; SMN2NPSR1HSD17B10KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103694187-A 5-amino-1-benzamido tetrazole and metal complex thereof UNIV SICHUAN 2014-04-02 CN disclosed
CN-103694187-A 5-amino-1-benzamido tetrazole and metal complex thereof UNIV SICHUAN 2014-04-02 CN disclosed
CN-103694187-A 5-amino-1-benzamido tetrazole and metal complex thereof UNIV SICHUAN 2014-04-02 CN disclosed
EP-0135032-B1 CARBAMATES AND OXALYL AMIDES OF AMINO-N-(1H-TETRAZOL-5-YL) BENZAMIDES MERRELL DOW PHARMACEUTICALS INC. (US) 1987-09-30 EP disclosed
US-4526979-A Carbamates and oxalamides of amino-N-(1H-tetrazol-5-yl)benzamides MERRELL DOW PHARMACEUTICALS INC. (US) 1985-07-02 US disclosed
EP-0135032-A1 Carbamates and oxalyl amides of amino-N-(1H-tetrazol-5-yl) benzamides MERRELL DOW PHARMACEUTICALS INC. (US) 1985-03-27 EP disclosed