SCHEMBL28293884

SCHEMBL28293884

CCN(C)C=Nc1cc(C)c(Cc2ccc(Br)cc2)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32
PYCR1 P32322 2/20 0.31
PDE3B Q13370 1/20 0.30
PDE3A Q14432 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
SCHEMBL28293773 0.86 ENPP1 (0.33)
SCHEMBL28292062 0.86 CHRM4 (0.37) KDM4EALDH1A1
SCHEMBL28292058 0.86 TAAR1 (0.38) TAAR1PYCR1
SCHEMBL28872646 0.85 ALDH1A1 (0.38) ALDH1A1
SCHEMBL28293764 0.83 CYP2A6 (0.37) KDM4EALDH1A1
SCHEMBL28293755 0.82 ALDH1A1 (0.32) ALDH1A1
SCHEMBL28292063 0.82 RIPK1 (0.30)
SCHEMBL28292035 0.82 KMT2A (0.42) ALDH1A1PYCR1
SCHEMBL28292045 0.81 KMT2A (0.30)
SCHEMBL28293774 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109843056-A 4-substituted phenylamine derivatives and their use for protecting crops against undesired phytopathogenic microorganisms 印度商皮埃企业有限公司 2019-06-04 CN claimed
CN-109843056-A 4-substituted phenylamine derivatives and their use for protecting crops against undesired phytopathogenic microorganisms 印度商皮埃企业有限公司 2019-06-04 CN disclosed