SCHEMBL30969482

SCHEMBL30969482

Clc1nnc(Cl)c2cc3ccccc3cc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
CYP2A6 P11509 2/20 0.44
GOT1 P17174 1/20 0.43
PI4KA P42356 1/20 0.42
PI4K2B Q8TCG2 1/20 0.42
PI4K2A Q9BTU6 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 4/20 0.40
SOD1 P00441 1/20 0.40
NQO2 P16083 1/20 0.40
HIF1A Q16665 1/20 0.40
CYP1B1 Q16678 1/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GFER P55789 1/20 0.39
NQO1 P15559 1/20 0.39
CYP1A2 P05177 1/20 0.39
ESR1 P03372 2/20 0.38

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
SCHEMBL8423973 1.00 MAPT (0.45) MAPTCYP2A6GOT1PI4KAPI4K2B
SCHEMBL31572194 1.00 MAPT (0.45) MAPTCYP2A6GOT1PI4KAPI4K2B
SCHEMBL28471578 0.84 KDM4E (0.44) MAPTALDH1A1HSD17B10KMT2ACYP1A2
SCHEMBL22440004 0.82 MAPT (0.39) MAPTCYP2A6GOT1PI4KAPI4K2B
SCHEMBL31572190 0.82 MAPT (0.39) MAPTCYP2A6GOT1PI4KAPI4K2B
SCHEMBL22440000 0.78 MEN1 (0.71) MAPTTDP1ALDH1A1HSD17B10KMT2A
SCHEMBL31572201 0.78 MEN1 (0.71) MAPTTDP1ALDH1A1HSD17B10KMT2A
SCHEMBL345211 0.77 GOT1 (0.62) MAPTCYP2A6GOT1TDP1ALDH1A1
SCHEMBL29365992 0.77 GOT1 (0.62) MAPTCYP2A6GOT1TDP1ALDH1A1
SCHEMBL15757917 0.75 CYP2A6 (0.50) MAPTCYP2A6TDP1ALDH1A1NQO2

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-117942786-A Preparation method of nanofiltration membrane and nanofiltration membrane prepared by same 沃顿科技股份有限公司 2024-04-30 CN disclosed