SCHEMBL7665641

SCHEMBL7665641

CNC(=C[N+](=O)[O-])N(Cc1cnc(Cl)s1)CC(F)(F)F

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.36
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 2/20 0.33
BMP1 P13497 1/20 0.32
KMT2A Q03164 3/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 2/20 0.31
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
ACHE P22303 2/20 0.30
SLC22A1 O15245 1/20 0.30
ABCB11 O95342 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
TSHR P16473 1/20 0.30
ADRA2C P18825 1/20 0.30
NFKB1 P19838 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL236048 0.86 RECQL (0.36) RECQLPOLBGAAMAPTBMP1
SCHEMBL236049 0.86 RECQL (0.36) RECQLPOLBGAAMAPTBMP1
SCHEMBL7679007 0.86 RECQL (0.36) RECQLPOLBGAAMAPTBMP1
SCHEMBL7662478 0.86 RECQL (0.36) RECQLPOLBGAAMAPTBMP1
SCHEMBL7670572 0.86 RECQL (0.35) RECQLPOLBGAAMAPTBMP1
SCHEMBL7683790 0.82 RECQL (0.38) RECQLPOLBGAAMAPTBMP1
SCHEMBL7660109 0.82 RECQL (0.38) RECQLPOLBGAAMAPTBMP1
SCHEMBL7668954 0.80 RECQL (0.36) RECQLPOLBGAAMAPTBMP1
SCHEMBL7668662 0.80 ALDH1A1 (0.36) MAPTKMT2AALDH1A1MEN1CYP2C19
SCHEMBL8401739 0.78 RECQL (0.36) RECQLPOLBGAAMAPTBMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407248-B1 INSECTICIDES, MITICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-18 US disclosed
US-6124297-A COMBATTING INSECTS OR MITES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-26 US disclosed
EP-0529680-B1 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-05-13 EP disclosed
US-5214152-A Insecticides, miticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-05-25 US disclosed
EP-0529680-A2 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-03-03 EP disclosed
US-5175301-A Insecticide, miticide, pesticide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-29 US disclosed
EP-0509559-A2 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-21 EP disclosed
EP-0302389-A2 Alpha-unsaturated amines, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed