SCHEMBL6883698

SCHEMBL6883698

Cc1ccc(-c2ncsn2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
POLB P06746 2/20 0.39
NOTUM Q6P988 1/20 0.39
MEN1 O00255 2/20 0.38
NPC1 O15118 5/20 0.35
RAB9A P51151 5/20 0.35
NFKB1 P19838 3/20 0.35
NFKB2 Q00653 3/20 0.35
RELA Q04206 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
METAP2 P50579 1/20 0.35
METAP1 P53582 1/20 0.35
HPGD P15428 1/20 0.35
NISCH Q9Y2I1 1/20 0.35
ALDH1A1 P00352 3/20 0.35
ADORA3 P0DMS8 1/20 0.35
ADORA1 P30542 1/20 0.35
PPARA Q07869 1/20 0.35
ACHE P22303 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL5097638 0.78 MEN1 (0.48) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL3139411 0.78 NPC1 (0.42) KMT2AMEN1NPC1RAB9ANFKB1
SCHEMBL908806 0.77 NPC1 (0.46) KMT2APOLBNOTUMMEN1NPC1
SCHEMBL4383111 0.74 TP53 (0.46) POLBNPC1RAB9AALDH1A1TDP1
SCHEMBL12890439 0.74 TDP1 (0.39) KMT2APOLBMEN1NPC1RAB9A
SCHEMBL5095475 0.71 XDH (0.47) KMT2APOLBMEN1NPC1RAB9A
SCHEMBL23665406 0.68 ALDH1A1 (0.54) KMT2APOLBNOTUMMEN1NPC1
SCHEMBL11810896 0.68 L3MBTL1 (0.52) KMT2AMEN1NPC1RAB9ANFKB1
SCHEMBL6111135 0.68 L3MBTL1 (0.52) KMT2AMEN1NPC1RAB9ANFKB1
SCHEMBL738443 0.67 CCR1 (0.46) KMT2AMEN1NPC1RAB9ANFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6821992-B1 ESPECIALLY AGAINST FUNGAL DISEASES OF PLANTS, E.G. MILDEWS AND PARTICULARLY CEREAL POWDERY MILDEW (ERYSIPHE GRAMINIS) AND VINE DOWNY MILDEW (PLASMOPARA VITICOLA), RICE BLAST (PYRICULARIA ORYZAE), ETC. AVENTIS CROPSCIENCE S.A. (FR) 2004-11-23 US disclosed