SCHEMBL6763941

SCHEMBL6763941

COC(=O)CCCCC=C(C)CCC=C(C)C

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 2/20 0.51
SQLE Q14534 1/20 0.51
LMNA P02545 1/20 0.51
FNTA P49354 3/20 0.50
FNTB P49356 3/20 0.50
ALOX15 P16050 1/20 0.50

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
SCHEMBL6763939 1.00 KMT2A (0.53) KMT2AALDH1A1SQLELMNAFNTA
SCHEMBL5883708 0.91 ALDH1A1 (0.60) KMT2AALDH1A1LMNAALOX15
SCHEMBL5321097 0.89 KMT2A (0.61) KMT2AALDH1A1SQLEFNTAFNTB
SCHEMBL17554314 0.89 KMT2A (0.61) KMT2AALDH1A1SQLEFNTAFNTB
SCHEMBL28052471 0.89 KMT2A (0.61) KMT2AALDH1A1SQLEFNTAFNTB
SCHEMBL11215304 0.89 KMT2A (0.61) KMT2AALDH1A1SQLEFNTAFNTB
SCHEMBL10916246 0.89 KMT2A (0.61) KMT2AALDH1A1SQLEFNTAFNTB
SCHEMBL17520245 0.89 LMNA (0.63) KMT2AALDH1A1LMNA
SCHEMBL10916255 0.89 KMT2A (0.61) KMT2AALDH1A1SQLEFNTAFNTB
SCHEMBL17685650 0.87 EPHX2 (0.47) KMT2AALDH1A1SQLELMNAFNTA

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
US-6726911-B1 SOLVENT EXTRACT; MICROBIOCIDES; ENDOPEPTIDASE, ANGIOTENSIN CONVERTING ENZYME AND SERUM-MEDIATED-BINDING OF LIPOPOLYSACCHARIDE INHIBITORS GANOMYCIN (DE) 2004-04-27 US disclosed