Neburon

Neburon

SCHEMBL28098481

CC(=O)Nc1ccccc1.CCCCN(C)C(=O)Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
APEX1 P27695 1/20 0.51
ALDH1A1 P00352 3/20 0.49
GAA P10253 2/20 0.49
KDM4E B2RXH2 1/20 0.49
GLA P06280 1/20 0.49
HPGD P15428 1/20 0.49
EGFR P00533 1/20 0.47
UBE2M P61081 2/20 0.47
DCUN1D1 Q96GG9 2/20 0.47
LMNA P02545 1/20 0.47
MOK Q9UQ07 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SLC6A3 Q01959 1/20 0.44
RORC P51449 1/20 0.43
NAPRT Q6XQN6 1/20 0.43

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
Neburon SCHEMBL8539331 0.89 APEX1 (0.63) POLBAPEX1ALDH1A1GAAKDM4E
Neburon SCHEMBL27181 0.89 APEX1 (0.63) POLBAPEX1ALDH1A1GAAKDM4E
SCHEMBL10944566 0.83 HTT (0.56) ALDH1A1GAAEGFRMAPTHTT
SCHEMBL11758211 0.81 APEX1 (0.67) POLBAPEX1ALDH1A1GAAKDM4E
Neburon SCHEMBL8665655 0.80 PKM (0.61) APEX1ALDH1A1GAAHPGDUBE2M
SCHEMBL20472451 0.79 APEX1 (0.60) APEX1ALDH1A1GAAKDM4EGLA
SCHEMBL13952345 0.79 ICMT (0.58) ALDH1A1GAAEGFRMAPTHTT
SCHEMBL11138778 0.78 APEX1 (0.60) POLBAPEX1ALDH1A1GAAKDM4E
SCHEMBL25226015 0.77 ICMT (0.61) ALDH1A1GAAEGFRMAPTHTT
SCHEMBL9725009 0.77 TSHR (0.60) POLBALDH1A1GAALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106215451-A For the method improving degree of crystallinity 普罗索尼克斯有限公司 2016-12-14 CN disclosed
CN-106061248-A Agricultural pesticide compositions 罗地亚经营管理公司 2016-10-26 CN disclosed
CN-102149438-B Method for increasing crystallinity 普罗索尼克斯有限公司 2016-09-21 CN disclosed