SCHEMBL28292092

SCHEMBL28292092

CCN(C)C=Nc1cc(C)c(Cc2cccc(N(C)C)c2)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
GPR52 Q9Y2T5 1/20 0.33
SIGMAR1 Q99720 5/20 0.33
ALDH1A1 P00352 3/20 0.33
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NOS1 P29475 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CHRM4 P08173 1/20 0.30
DRD2 P14416 1/20 0.30
HTR7 P34969 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
SCHEMBL28292068 0.87 TAAR1 (0.39) SIGMAR1ALDH1A1KMT2AKDM4EMAPT
SCHEMBL28292062 0.87 CHRM4 (0.37) ALDH1A1TSHRKDM4EHPGDCHRM4
SCHEMBL28292058 0.86 TAAR1 (0.38) SIGMAR1
SCHEMBL28293765 0.83 IDH1 (0.37) KMT2A
SCHEMBL28872646 0.83 ALDH1A1 (0.38) ALDH1A1MAPT
SCHEMBL28293755 0.80 ALDH1A1 (0.32) ALDH1A1
SCHEMBL28292063 0.80 RIPK1 (0.30)
SCHEMBL28292035 0.80 KMT2A (0.42) SIGMAR1ALDH1A1TSHRKMT2AMAPT
SCHEMBL28293884 0.79 KDM4E (0.33) ALDH1A1KDM4E
SCHEMBL28292065 0.79 LMNA (0.35) KMT2AKDM4E

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