SCHEMBL11042236

SCHEMBL11042236

CCCCCCCCCCCCC#CC#CCCCCCCCCC(=O)NC(C)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ASAH1 Q13510 2/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ ACER2 Q5QJU3 1/20 0.60
▸ MAPT P10636 1/20 0.52
▸ CERT1 Q9Y5P4 3/20 0.52
▸ HMGCR P04035 1/20 0.51
▸ POLB P06746 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ SELP P16109 1/20 0.50
▸ GAA P10253 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
SCHEMBL6872320 0.95 MAPT (0.57) ASAH1ALDH1A1ACER2MAPTHPGD
SCHEMBL10898940 0.95 MAPT (0.57) ASAH1ALDH1A1ACER2MAPTHPGD
SCHEMBL10891449 0.90 MAPT (0.52) ASAH1ALDH1A1ACER2MAPTCERT1
SCHEMBL10978959 0.90 MAPT (0.52) ASAH1ALDH1A1ACER2MAPTHPGD
SCHEMBL4139305 0.89 ALDH1A1 (0.72) ASAH1ALDH1A1ACER2MAPTCERT1
SCHEMBL5599045 0.89 ALDH1A1 (0.72) ASAH1ALDH1A1ACER2MAPTCERT1
SCHEMBL4139311 0.89 ALDH1A1 (0.72) ASAH1ALDH1A1ACER2MAPTCERT1
SCHEMBL9472620 0.89 ALDH1A1 (0.72) ASAH1ALDH1A1ACER2MAPTCERT1
SCHEMBL4183115 0.89 ALDH1A1 (0.72) ASAH1ALDH1A1ACER2MAPTCERT1
SCHEMBL12215278 0.89 ALDH1A1 (0.72) ASAH1ALDH1A1ACER2MAPTCERT1

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-4439514-A Photoresistive compositions UNIVERSITY PATENTS, INC. (US) 1984-03-27 — — US disclosed
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