SCHEMBL9345674

SCHEMBL9345674

Cc1csc(NC(=O)C(C#N)=NO)n1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.50
▸ RAB9A P51151 11/20 0.47
▸ NPC1 O15118 9/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ POLB P06746 3/20 0.45
▸ HPGD P15428 3/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ GAA P10253 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ RCE1 Q9Y256 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ PKM P14618 1/20 0.43
▸ CNR2 P34972 1/20 0.43

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
SCHEMBL9345666 1.00 MAPT (0.50) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL9463368 0.85 MAPT (0.47) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL6374526 0.79 MAPT (0.53) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL9080024 0.77 RAB9A (0.50) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL8809685 0.77 RAB9A (0.50) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL9463686 0.76 MAPK1 (0.53) RAB9ANPC1HSD17B10POLBHPGD
SCHEMBL11225467 0.75 MAPT (0.62) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL10816647 0.72 RAB9A (0.71) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL1691061 0.72 MAPT (0.68) MAPTRAB9ANPC1HSD17B10POLB
SCHEMBL11225869 0.72 MAPT (0.58) MAPTRAB9ANPC1HSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5288732-A Fungicides for plants BAYER AKTIENGESELLSCHAFT (DE) 1994-02-22 — — US disclosed
US-5231109-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1993-07-27 — — US disclosed
US-4886833-A FUNGICIDES, PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1989-12-12 — — US disclosed
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