SCHEMBL28423348

SCHEMBL28423348

N#Cc1c(C(=O)O)cccc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
TDP1 Q9NUW8 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
DNA2 P51530 1/20 0.44
CASP6 P55212 1/20 0.44
CTDSP1 Q9GZU7 1/20 0.44
GPR35 Q9HC97 1/20 0.44
CTSD P07339 1/20 0.42
POLB P06746 1/20 0.42
GLA P06280 1/20 0.42
DTYMK P23919 1/20 0.41
APEX1 P27695 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL8833707 0.85 TSHR (0.60) TSHRTDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL16958015 0.83 TSHR (0.46) TSHRTDP1L3MBTL1ALDH1A1MEN1
SCHEMBL11199679 0.83 CES2 (0.52) TSHRTDP1ALDH1A1KDM4EGAA
SCHEMBL618153 0.82 TDP1 (0.54) TSHRTDP1ALDH1A1MEN1KMT2A
SCHEMBL13424880 0.81 SLC6A2 (0.55) TSHRALDH1A1KDM4EMEN1MAPT
SCHEMBL2413505 0.81 TSHR (0.44) TSHRTDP1L3MBTL1ALDH1A1MEN1
SCHEMBL16957945 0.78 TSHR (0.42) TSHRTDP1L3MBTL1ALDH1A1KDM4E
Thiocyanic Acid SCHEMBL27796510 0.78 TSHR (0.56) TSHRTDP1ALDH1A1KDM4EMEN1
Acetonitrile SCHEMBL28323453 0.78 TSHR (0.60) TSHRTDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL621936 0.77 GPR35 (0.56) TDP1ALDH1A1KDM4EMAPTGPR35

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108107211-B Single spacer for improved lateral flow assay 阿赛斯生物股份有限公司 2020-06-09 CN claimed