SCHEMBL28615862

SCHEMBL28615862

O=Cc1ccc(Cl)cc1F.OBO

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
ERN1 O75460 9/20 0.50
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC9 Q9UKV0 1/20 0.37
HDAC5 Q9UQL6 1/20 0.37
PTPN1 P18031 1/20 0.37
GRM2 Q14416 1/20 0.36
GPR183 P32249 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL155661 0.92 TDP1 (0.61) TDP1ERN1HDAC3HDAC4HDAC1
SCHEMBL14774601 0.79 TDP1 (0.52) TDP1ERN1HDAC3HDAC4HDAC1
SCHEMBL14774600 0.79 TDP1 (0.52) TDP1ERN1HDAC3HDAC4HDAC1
SCHEMBL42333 0.77 ERN1 (0.59) TDP1ERN1PTPN1KMT2ALMNA
SCHEMBL29958016 0.77 ERN1 (0.59) TDP1ERN1PTPN1KMT2ALMNA
SCHEMBL4552823 0.77 TDP1 (0.48) TDP1ERN1HSD17B10
SCHEMBL25078545 0.74 TDP1 (0.55) TDP1ERN1PTPN1HSD17B10
SCHEMBL21676102 0.73 TDP1 (0.44) TDP1ERN1HDAC3HDAC4HDAC1
SCHEMBL16599459 0.73 TDP1 (0.44) TDP1ERN1HDAC3HDAC4HDAC1
SCHEMBL28336792 0.73 TDP1 (0.53) TDP1ERN1PTPN1GRM2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113133969-B Glucose-responsive insulin multivesicular liposome and preparation method and application thereof 中国药科大学 2022-10-14 CN disclosed
CN-113133969-A Glucose-responsive insulin multivesicular liposome and preparation method and application thereof 中国药科大学 2021-07-20 CN disclosed