SCHEMBL7664945

SCHEMBL7664945

CCCCN(C(=O)NC)c1ccc(Cl)nc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 3/20 0.44
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
HDAC6 Q9UBN7 2/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
FAAH O00519 1/20 0.38
HDAC1 Q13547 1/20 0.37
AGTR1 P30556 1/20 0.36
AGTR2 P50052 1/20 0.36
NPC1 O15118 3/20 0.35
RAB9A P51151 2/20 0.35
PAX8 Q06710 2/20 0.35
JAK2 O60674 1/20 0.35
FFAR2 O15552 1/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
TP53 P04637 1/20 0.34

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
SCHEMBL7660392 0.92 ALDH1A1 (0.44) ROCK2ALDH1A1MEN1KMT2ALMNA
SCHEMBL7667371 0.86 MEN1 (0.49) ROCK2ALDH1A1MEN1KMT2ALMNA
SCHEMBL7670090 0.84 LMNA (0.37) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL7669449 0.78 MAPT (0.34) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL10625003 0.78 ROCK2 (0.43) ROCK2ALDH1A1HDAC6HDAC1AGTR1
SCHEMBL10536299 0.78 TSHR (0.48) ROCK2ALDH1A1LMNAHDAC6HDAC1
SCHEMBL9337303 0.75 HDAC6 (0.58) ROCK2ALDH1A1MEN1KMT2AHDAC6
SCHEMBL7668563 0.75 MEN1 (0.39) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL7671929 0.74 MEN1 (0.36) ALDH1A1MEN1KMT2ALMNAMAPT
SCHEMBL7671934 0.74 MEN1 (0.36) ALDH1A1MEN1KMT2ALMNAMAPT

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 10 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
US-5849768-A α-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-15 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
EP-0302389-B1 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-22 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