SCHEMBL27940784

SCHEMBL27940784

CCCCOc1ccc(-c2c(C(N)=O)cccc2C(N)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.52
▸ NR1I2 O75469 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ CHRM2 P08172 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ ADRA2A P08913 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ OPRK1 P41145 1/20 0.52
▸ HTR2B P41595 1/20 0.52
▸ SLC6A3 Q01959 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ HDAC6 Q9UBN7 1/20 0.52
▸ RARB P10826 4/20 0.49
▸ CHEK1 O14757 1/20 0.46
▸ MAP4K4 O95819 1/20 0.46
▸ LCK P06239 1/20 0.46
▸ CSF1R P07333 1/20 0.46
▸ PIM1 P11309 1/20 0.46
▸ PHKG2 P15735 1/20 0.46
▸ MARK3 P27448 1/20 0.46

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
SCHEMBL27730967 0.84 MEN1 (0.46) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL27731011 0.82 HTT (0.47) RARBCHEK1MAP4K4LCKCSF1R
SCHEMBL9453349 0.80 MEN1 (0.62) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL28025514 0.80 RARB (0.51) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL27731010 0.80 LMNA (0.51) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL27731003 0.80 LMNA (0.51) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL28774632 0.79 PARP1 (0.39) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL15412857 0.79 PARP1 (0.58) MEN1KMT2ACHEK1MAP4K4PARP1
SCHEMBL28770640 0.78 MCL1 (0.54) MEN1NR1I2LMNACHRM2CYP3A4
SCHEMBL28774631 0.78 PTPN11 (0.49) MEN1NR1I2LMNACHRM2CYP3A4

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-103373939-A 4-methoxy-N, N'-bisubstituted phenyl-1, 3-benzene diamide compounds as well as preparation method and application thereof UNIV TIANJIN TECHNOLOGY 2013-10-30 — — CN claimed
CN-103373939-A 4-methoxy-N, N'-bisubstituted phenyl-1, 3-benzene diamide compounds as well as preparation method and application thereof UNIV TIANJIN TECHNOLOGY 2013-10-30 — — CN disclosed
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