SCHEMBL28043716

SCHEMBL28043716

Nc1ccc(N)c(C(=O)C(Cl)Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 4/20 0.57
THRB P10828 4/20 0.57
KMT2A Q03164 4/20 0.57
TDP1 Q9NUW8 4/20 0.57
MAPT P10636 4/20 0.57
MEN1 O00255 3/20 0.57
POLB P06746 2/20 0.57
USP2 O75604 1/20 0.57
PKM P14618 1/20 0.57
APEX1 P27695 1/20 0.57
BLM P54132 1/20 0.57
MCL1 Q07820 1/20 0.57
KDM4E B2RXH2 6/20 0.42
ALDH1A1 P00352 6/20 0.42
CYP3A4 P08684 4/20 0.42
ALOX15 P16050 4/20 0.42
HSD17B10 Q99714 3/20 0.42
HPGD P15428 2/20 0.42
CASP1 P29466 2/20 0.42
TNF P01375 1/20 0.42

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
SCHEMBL31481316 0.78 MAPT (0.60) RECQLTHRBKMT2ATDP1MAPT
SCHEMBL27916167 0.77 KMT2A (0.53) RECQLTHRBKMT2ATDP1MAPT
SCHEMBL5860116 0.77 ALDH1A1 (0.51) MAPTPOLBUSP2KDM4EALDH1A1
SCHEMBL107833 0.74 KMT2A (0.95) RECQLTHRBKMT2ATDP1MAPT
SCHEMBL1708814 0.74 KMT2A (0.65) RECQLTHRBKMT2ATDP1MAPT
SCHEMBL1682394 0.72 KMT2A (0.63) RECQLTHRBKMT2ATDP1MAPT
SCHEMBL31268209 0.72 KMT2A (0.63) RECQLTHRBKMT2ATDP1MAPT
Hydrochloric Acid SCHEMBL864766 0.72 KMT2A (1.00) RECQLTHRBKMT2ATDP1MAPT
SCHEMBL11219888 0.72 THRB (0.57) RECQLTHRBKMT2ATDP1MAPT
SCHEMBL10797389 0.72 MEN1 (0.47) RECQLTHRBKMT2ATDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106349167-B Benzimidizole derivatives phosphate anion fluorescence probe synthesizes and application method 齐齐哈尔大学 2018-10-19 CN claimed
CN-105148793-B Preparation method of Aniline surfactant 齐齐哈尔大学 2017-02-22 CN claimed
CN-106349167-A Benzimidazole derivative phosphate anion fluorescence probe synthesis and application method 齐齐哈尔大学 2017-01-25 CN claimed
CN-105148793-A Aniline surfactant and preparation method therefor UNIV QIQIHAR 2015-12-16 CN claimed
CN-106349167-B Benzimidizole derivatives phosphate anion fluorescence probe synthesizes and application method 齐齐哈尔大学 2018-10-19 CN disclosed
CN-106349167-B Benzimidizole derivatives phosphate anion fluorescence probe synthesizes and application method 齐齐哈尔大学 2018-10-19 CN disclosed
CN-105148793-B Preparation method of Aniline surfactant 齐齐哈尔大学 2017-02-22 CN disclosed
CN-105148793-B Preparation method of Aniline surfactant 齐齐哈尔大学 2017-02-22 CN disclosed
CN-106349167-A Benzimidazole derivative phosphate anion fluorescence probe synthesis and application method 齐齐哈尔大学 2017-01-25 CN disclosed
CN-105148793-A Aniline surfactant and preparation method therefor UNIV QIQIHAR 2015-12-16 CN disclosed
CN-105148793-A Aniline surfactant and preparation method therefor UNIV QIQIHAR 2015-12-16 CN disclosed