SCHEMBL9199161

SCHEMBL9199161

CCN(Cc1cnc(Cl)s1)C(=C[N+](=O)[O-])N(C)C=O

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
RECQL P46063 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
PKM P14618 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
BMP1 P13497 1/20 0.31

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
SCHEMBL7662085 0.90 MAPT (0.36) MAPTRECQLKDM4EMEN1LMNA
SCHEMBL7670866 0.89 PDK1 (0.31)
SCHEMBL9193825 0.87 MAPT (0.36) MAPTRECQLKDM4EMEN1LMNA
SCHEMBL7664835 0.86 MAPT (0.36) MAPTRECQLKDM4EMEN1LMNA
SCHEMBL7672471 0.80 MAPT (0.36) MAPTRECQLKDM4EMEN1LMNA
SCHEMBL7679007 0.79 RECQL (0.36) MAPTRECQLKDM4EMEN1LMNA
SCHEMBL236048 0.79 RECQL (0.36) MAPTRECQLKDM4EMEN1LMNA
SCHEMBL236049 0.79 RECQL (0.36) MAPTRECQLKDM4EMEN1LMNA
SCHEMBL7657366 0.79 CHRNB2 (0.36) MAPTMEN1KMT2A
SCHEMBL7662516 0.78 MAPT (0.39) MAPTRECQLKDM4EMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0496106-B1 Stable agrochemical compositions TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-12-20 EP disclosed
US-5230893-A Pesticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-07-27 US disclosed
US-5175301-A Insecticide, miticide, pesticide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-29 US disclosed
EP-0496106-A1 Stable agrochemical compositions Takeda Chemical Industries, Ltd. (JP) 1992-07-29 EP disclosed