SCHEMBL7838461

SCHEMBL7838461

CCc1nn(C)c(N)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.59
CYP2C9 P11712 1/20 0.44
GFER P55789 1/20 0.44
KDM4E B2RXH2 1/20 0.31
NR3C1 P04150 1/20 0.31
MAPK8 P45983 1/20 0.31
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
LMNA P02545 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
SCHEMBL4857472 0.77 GAA (0.63) GAACYP2C9GFER
SCHEMBL12871626 0.76 CYP2C9 (0.41) GAACYP2C9GFERNR3C1MAPK8
SCHEMBL12871802 0.76 GAA (0.45) GAACYP2C9GFERKDM4ENR3C1
SCHEMBL971293 0.72 CYP2C9 (0.40) GAACYP2C9GFERNR3C1MAPK8
SCHEMBL22315243 0.72 CYP2C9 (0.40) GAACYP2C9GFERNR3C1MAPK8
SCHEMBL27859446 0.72 CYP2C9 (0.40) GAACYP2C9GFERNR3C1MAPK8
SCHEMBL27488817 0.71 SMN1; SMN2 (0.48) GAACYP2C9GFERKDM4ENR3C1
SCHEMBL28139455 0.71 CYP2C9 (0.39) GAACYP2C9GFER
SCHEMBL12859147 0.71 CYP2C9 (0.39) GAACYP2C9GFERLMNA
SCHEMBL4352928 0.70

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
EP-1107956-A2 USE OF 5-AMINO-PYRAZOL-DERIVATIVES FOR COMBATING MICRO-ORGANISMS BAYER AG (DE) 2001-06-20 EP disclosed
US-6100288-A EFFICIENCY; PESTICIDES, AGRICULTURE, STORAGE, HYGIENE BAYER AKTIENGESELLSCHAFT (DE) 2000-08-08 US disclosed
WO-2000011951-A2 USE OF 5-AMINO-PYRAZOL-DERIVATIVES FOR COMBATING MICRO-ORGANISMS BAYER AKTIENGESELLSCHAFT (DE) 2000-03-09 WO disclosed
US-5981566-A FOR CONTROLLING ANIMAL PESTS, IN PARTICULAR INSECTS, ARACHNIDS AND NEMATODES BAYER AKTIENGESELLSCHAFT (DE) 1999-11-09 US disclosed
US-5843978-A Acylated 5-aminopyrazoles and the use thereof to combat animal parasites BAYER AKTIENGESELLSCHAFT (DE) 1998-12-01 US disclosed
CN-1172479-A Acylated 5-aminopyrrole BAYER AG (DE) 1998-02-04 CN disclosed
EP-0802907-A1 ACYLATED 5-AMINOPYRAZOLES AND THE USE THEREOF TO COMBAT ANIMAL PARASITES BAYER AG (DE) 1997-10-29 EP disclosed
WO-1996021653-A1 ACYLATED 5-AMINOPYRAZOLES AND THE USE THEREOF TO COMBAT ANIMAL PARASITES BAYER AKTIENGESELLSCHAFT (DE) 1996-07-18 WO disclosed