SCHEMBL28038484

SCHEMBL28038484

NCCCCCCc1cc(C(N)=O)ccc1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.42
HTR1A P08908 4/20 0.42
HTR2C P28335 4/20 0.42
HTR1D P28221 3/20 0.42
HTR1B P28222 2/20 0.42
HTR7 P34969 2/20 0.42
HTR5A P47898 2/20 0.42
HTR6 P50406 2/20 0.42
TSHR P16473 2/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
KMT2A Q03164 1/20 0.42
HSD17B10 Q99714 1/20 0.42
JAK2 O60674 4/20 0.40
JAK1 P23458 4/20 0.40
TYK2 P29597 4/20 0.40
JAK3 P52333 4/20 0.40
SLC6A2 P23975 2/20 0.37
LMNA P02545 1/20 0.37
ADRA2A P08913 1/20 0.37

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
SCHEMBL9709120 0.98 HTR1A (0.43) CHEK1HTR1AHTR2CHTR1DHTR1B
SCHEMBL29027761 0.87 CYP4F2 (0.37) CHEK1HTR1AHTR2CHTR1DHTR1B
SCHEMBL28080162 0.86 MEN1 (0.45) TSHRMEN1KMT2ALMNAADRA2A
SCHEMBL27699889 0.86 MEN1 (0.45) TSHRMEN1KMT2ALMNAADRA2A
SCHEMBL27804389 0.86 MEN1 (0.45) TSHRMEN1KMT2ALMNAADRA2A
SCHEMBL29290752 0.86 MEN1 (0.45) TSHRMEN1KMT2ALMNAADRA2A
SCHEMBL27721837 0.86 MEN1 (0.45) TSHRMEN1KMT2ALMNAADRA2A
SCHEMBL20553924 0.86 MEN1 (0.45) TSHRMEN1KMT2ALMNAADRA2A
SCHEMBL27886029 0.84 MEN1 (0.44) TSHRMEN1KMT2ALMNAADRA2A
SCHEMBL17474254 0.84 HTR1A (0.42) HTR1AHTR2CHTR1DHTR1BHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113045567-B Phosphatase recruitment chimera (PHORCs) compound based on protein phosphatase 5, preparation method and medical application thereof 中国药科大学 2023-01-31 CN disclosed
CN-113045567-A Phosphatase recruitment chimera (PHORCs) compound based on protein phosphatase 5, preparation method and medical application thereof 中国药科大学 2021-06-29 CN disclosed
CN-105175715-B Copolymer and method for preparing monomer for forming the same 财团法人工业技术研究院 2018-03-13 CN disclosed
CN-105175715-A Copolymer and method for preparing monomer for forming the same IND TECH RES INST 2015-12-23 CN disclosed