SCHEMBL9768600

SCHEMBL9768600

CC(=NN)c1ccncc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 5/20 0.44
MEN1 O00255 2/20 0.44
GAA P10253 6/20 0.42
MAPT P10636 3/20 0.42
GFER P55789 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
TP53 P04637 1/20 0.41
CYP17A1 P05093 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP19A1 P11511 1/20 0.41
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
POLB P06746 1/20 0.41
RECQL P46063 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.40

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
SCHEMBL5326497 1.00 L3MBTL1 (0.50) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL27974672 0.80 L3MBTL1 (0.53) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL1253507 0.80 L3MBTL1 (0.53) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL15452358 0.78 L3MBTL1 (0.52) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL2954565 0.78 L3MBTL1 (0.52) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL2954564 0.78 L3MBTL1 (0.52) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL11482231 0.78 L3MBTL1 (0.52) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL3655561 0.75 LMNA (0.50) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL1005102 0.75 LMNA (0.50) L3MBTL1KDM4EALDH1A1KMT2AMEN1
SCHEMBL4041540 0.75 LMNA (0.50) L3MBTL1KDM4EALDH1A1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5011932-A Anthelmintic pyridinyl acylhydrazones derivatives UPJOHN COMPANY (US) 1991-04-30 US claimed
EP-0214158-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-03-18 EP claimed
WO-1986004582-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1986-08-14 WO claimed
US-5023334-A Anthelmintic pyridinyl acylhydrazones THE UPJOHN COMPANY (US) 1991-06-11 US disclosed
US-5011932-A Anthelmintic pyridinyl acylhydrazones derivatives UPJOHN COMPANY (US) 1991-04-30 US disclosed
EP-0214158-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-03-18 EP disclosed
WO-1986004582-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1986-08-14 WO disclosed