SCHEMBL28091035

SCHEMBL28091035

O=C(Nc1ccccc1)c1ccc(Cl)c(Cl)c1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR27 Q9NS67 1/20 0.57
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
HPGD P15428 2/20 0.54
LMNA P02545 2/20 0.54
TP53 P04637 2/20 0.54
HTT P42858 2/20 0.54
KDM4E B2RXH2 1/20 0.54
HSD17B10 Q99714 1/20 0.54
TMPRSS4 Q9NRS4 1/20 0.54
MAPT P10636 4/20 0.54
CYP2C19 P33261 3/20 0.54
CYP1A2 P05177 3/20 0.54
CYP2C9 P11712 3/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2D6 P10635 2/20 0.54
ATM Q13315 1/20 0.54
ALDH1A1 P00352 1/20 0.51
SMO Q99835 1/20 0.51
PPARG P37231 3/20 0.51

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
SCHEMBL766989 0.84 HSPD1 (0.54) GPR27MEN1KMT2AHPGDLMNA
SCHEMBL766990 0.84 HSPD1 (0.57) GPR27MEN1KMT2AHPGDLMNA
SCHEMBL2169634 0.84 MEN1 (0.68) MEN1KMT2AHPGDLMNATP53
SCHEMBL6252378 0.82 P2RX1 (0.58) MEN1KMT2AHPGDHTTKDM4E
SCHEMBL30697245 0.82 P2RX1 (0.58) MEN1KMT2AHPGDHTTKDM4E
SCHEMBL2296409 0.82 TMPRSS4 (0.56) GPR27MEN1KMT2AHPGDLMNA
SCHEMBL8462377 0.81 HPGD (0.49) MEN1KMT2AHPGDLMNATP53
SCHEMBL5852388 0.81 KLKB1 (0.72) MEN1KMT2AHPGDLMNATP53
SCHEMBL1648370 0.80 GPR27 (0.53) GPR27MEN1KMT2AHPGDLMNA
SCHEMBL4155586 0.79 JAK2 (0.73) GPR27MEN1KMT2AHPGDLMNA

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-105806927-B The ion mobility spectrometry rapid detection method of 3 kinds of bromos or Chlorosalicylic anilide in cosmetics 中国检验检疫科学研究院 2018-08-17 CN disclosed
CN-105806927-A Quick detection method for ionic migration spectrum of 3 types of bromo or chloro salicyloyl anilines in cosmetics 中国检验检疫科学研究院 2016-07-27 CN disclosed