SCHEMBL8527241

SCHEMBL8527241

CC(C)(O)CCCC(C)(C)F.OF

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
KMT2A Q03164 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30

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
SCHEMBL23677751 0.82
SCHEMBL2818804 0.82 ALDH1A1 (0.69) ALDH1A1MEN1POLBAPEX1KMT2A
SCHEMBL17837076 0.76 ALDH1A1 (0.45) ALDH1A1
SCHEMBL10025732 0.76 ALDH1A1 (0.45) ALDH1A1
SCHEMBL1269985 0.75 ALDH1A1 (0.69) ALDH1A1MEN1POLBAPEX1KMT2A
SCHEMBL7602370 0.73 ALDH1A1 (0.56) ALDH1A1MEN1POLBAPEX1KMT2A
SCHEMBL22861878 0.73
SCHEMBL8526781 0.72 CYP4F2 (0.42) ALDH1A1MEN1KMT2A
SCHEMBL2945318 0.72 ALDH1A1 (0.64) ALDH1A1
SCHEMBL2943010 0.72 ALDH1A1 (0.64) ALDH1A1

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-5952375-A NEURAMINIDASE INHIBITOR FOR INHIBITION OF VIRUSES, IN PARTICULAR INFLUENZA VIRUSES; FDA ORANGE BOOK LISTED PATENT FOR OSELTAMIVIR PHOSPHATE GILEAD SCIENCES, INC. (US) 1999-09-14 US disclosed
US-5763483-A NEURAMINIDASE INHIBITOR TREATING INFLUENZA VIRUS INFECTION; OSELTAMIVIR OR THE FREE ACID THEREOF; FDA ORANGE BOOK LISTED PATENT FOR OSELTAMIVIR PHOSPHATE GILEAD SCIENCES, INC. (US) 1998-06-09 US disclosed