SCHEMBL29904702

SCHEMBL29904702

Nc1ccc(-c2ccc(C(=O)O)cc2)cc1N

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
KDM4E B2RXH2 2/20 0.55
GFER P55789 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
BCL2L1 Q07817 1/20 0.52
BAD Q92934 1/20 0.52
RXRA P19793 4/20 0.52
RXRB P28702 4/20 0.52
LMNA P02545 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
CA14 Q9ULX7 1/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
CYP17A1 P05093 1/20 0.49

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
SCHEMBL28566580 1.00 KMT2A (0.58) KMT2AMEN1TDP1KDM4EGFER
SCHEMBL9796871 1.00 KMT2A (0.58) KMT2AMEN1TDP1KDM4EGFER
Terephthalic Acid SCHEMBL1389243 0.98 KMT2A (0.61) KMT2AMEN1TDP1KDM4EGFER
SCHEMBL28569284 0.96 KMT2A (0.54) KMT2AMEN1TDP1KDM4EGFER
Sulfur Dioxide SCHEMBL28576865 0.94 KMT2A (0.52) KMT2AMEN1TDP1KDM4EGFER
SCHEMBL31084440 0.84 MAP4K4 (0.51) KMT2AKDM4EGFERRXFP1BCL2L1
SCHEMBL31084444 0.84 MAP4K4 (0.51) KMT2AKDM4EGFERRXFP1BCL2L1
SCHEMBL13171608 0.84 MAP4K4 (0.51) KMT2AKDM4EGFERRXFP1BCL2L1
SCHEMBL4336129 0.84 KDM4E (0.66) KMT2AMEN1KDM4EGFERRXFP1
SCHEMBL19361979 0.84 KMT2A (0.54) KMT2AMEN1TDP1KDM4EGFER

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-117895038-A Fiber reinforced high-temperature proton exchange membrane, preparation method thereof and electrochemical equipment 坤艾新材料科技(上海)有限公司 2024-04-16 CN disclosed
CN-112820920-B High-temperature proton exchange membrane, preparation method and electrochemical equipment 坤艾新材料科技(上海)有限公司 2022-11-18 CN disclosed
CN-112820922-B Ceramic particle reinforced high-temperature proton exchange membrane, manufacturing method thereof and electrochemical equipment 坤艾新材料科技(上海)有限公司 2022-09-02 CN disclosed