SCHEMBL11261558

SCHEMBL11261558

CCCCCCCCCC(=O)SCC(=O)NC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 1/20 0.51
MAPT P10636 1/20 0.51
HSP90AA1 P07900 1/20 0.46
FAAH O00519 2/20 0.44
CES2 O00748 3/20 0.42
CES1 P23141 3/20 0.42
MEN1 O00255 2/20 0.42
MAPK1 P28482 1/20 0.42
GPR84 Q9NQS5 7/20 0.41
PPARG P37231 7/20 0.41
PPARD Q03181 7/20 0.41
PPARA Q07869 7/20 0.41
HDAC11 Q96DB2 5/20 0.41
TSHR P16473 4/20 0.41
PTPN1 P18031 3/20 0.41
ALDH1A1 P00352 2/20 0.41
TLR2 O60603 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
FABP4 P15090 2/20 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
SCHEMBL11278421 1.00 KMT2A (0.51) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL11264555 1.00 KMT2A (0.51) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL11265815 1.00 KMT2A (0.51) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL11276917 0.93 MAPT (0.50) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL11267205 0.87 MAPT (0.43) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL1573059 0.81 HSP90AA1 (0.61) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL9410605 0.81 HSP90AA1 (0.61) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL29147871 0.81 HSP90AA1 (0.61) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL20724956 0.81 HSP90AA1 (0.61) KMT2AKDM4EMAPTHSP90AA1FAAH
SCHEMBL9410595 0.81 HSP90AA1 (0.61) KMT2AKDM4EMAPTHSP90AA1FAAH

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-4329363-A Substituted mercapto acid amides and their use MERCK & CO., INC. (US) 1982-05-11 US disclosed
US-4216160-A IMMUNOREGULANTS FOR CORRECTING AN INBALANCE OF IMMUNE HOMEOSTASIS MERCK & CO., INC. (US) 1980-08-05 US disclosed