SCHEMBL11404530

SCHEMBL11404530

CC(=O)OC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C

nearest known ligand 0.96

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.96
ALOX15 P16050 2/20 0.96
FNTA P49354 4/20 0.60
FNTB P49356 4/20 0.60
PGGT1B P53609 1/20 0.60
KMT2A Q03164 2/20 0.59
TRPV1 Q8NER1 2/20 0.56
MAPT P10636 2/20 0.53
MEN1 O00255 1/20 0.53
CYP3A4 P08684 1/20 0.53
UGT1A1 P22309 1/20 0.53

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
SCHEMBL28486071 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL11404533 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL11410939 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL806825 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL806928 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL1301763 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL806725 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL1301765 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL133908 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B
SCHEMBL806690 1.00 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4199587-A Method of treating hypertension with polyprenyl alcohol ester EISAI CO., LTD. (JP) 1980-04-22 US claimed
JP-54076513-A None JP disclosed
US-4175139-A Hypertension treating agent containing polyprenyl alcohol EISAI CO. LTD. (JP) 1979-11-20 US disclosed
JP-S5476513-A POLYPRENYL ALCOHOL ESTER AND HYPOTENSIVES CONTAINING IT EISAI CO LTD 1979-06-19 JP disclosed