SCHEMBL8092746

SCHEMBL8092746

CCCCC(=O)NC1=C(CCCC(C)C)c2ccccc2C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 1/20 0.51
PAX8 Q06710 1/20 0.51
HKDC1 Q2TB90 1/20 0.51
TLR9 Q9NR96 1/20 0.51
MAPT P10636 1/20 0.43
LMNA P02545 1/20 0.42
PKM P14618 1/20 0.42
PTPRC P08575 2/20 0.41
SOAT1 P35610 2/20 0.41
CETP P11597 1/20 0.41
GAA P10253 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 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
SCHEMBL8092932 0.94 TDP2 (0.52) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8100391 0.94 TDP2 (0.59) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8092735 0.91 TDP2 (0.57) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8106728 0.90 TDP2 (0.56) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8108502 0.89 MAPT (0.54) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8103028 0.89 TDP2 (0.54) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8100375 0.89 TDP2 (0.54) TDP2PAX8HKDC1TLR9PTPRC
SCHEMBL8108533 0.89 TDP2 (0.57) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8102478 0.87 KDM4E (0.40) TDP2PAX8HKDC1TLR9MAPT
SCHEMBL8102650 0.86 TDP2 (0.55) TDP2PAX8HKDC1TLR9MAPT

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
US-6013674-A INDENONE AMIDE DERIVATIVES, USEFUL FOR FOR THE INHIBITION OF LEUKOCYTE ADHERENCE TO ENDOTHELIAL CELLS; USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES, AS ARTHRITIS, ASTHAMA, PSORIASIS, RESPIRATORY DISTRESS SYNDROME, STROKE AND ULCER ELI LILLY AND COMPANY (US) 2000-01-11 US disclosed
EP-0882706-A1 Cell adhesion inhibitors ELI LILLY AND COMPANY (US) 1998-12-09 EP disclosed