SCHEMBL9789524

SCHEMBL9789524

CCCCCCCC/C=C/CCCCCCCCc1ccc(C(=O)O)cc1

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.74
MEN1 O00255 1/20 0.74
ALDH1A1 P00352 1/20 0.74
RARA P10276 1/20 0.74
MAPT P10636 1/20 0.74
MTOR P42345 1/20 0.74
KMT2A Q03164 1/20 0.74
ATG4B Q9Y4P1 10/20 0.60
PLA2G1B P04054 8/20 0.60
THRA P10827 1/20 0.60
THRB P10828 1/20 0.60
CYP1A2 P05177 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
RECQL P46063 1/20 0.60

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
SCHEMBL9789522 1.00 RARB (0.74) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL11494255 0.97 RARB (0.69) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL11494258 0.97 RARB (0.69) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL503506 0.90 RARB (0.90) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL1164529 0.90 RARB (0.90) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL82569 0.90 RARB (0.90) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL503648 0.90 RARB (0.90) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL270423 0.90 RARB (0.90) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL18979307 0.90 RARB (0.90) RARBMEN1ALDH1A1RARAMAPT
SCHEMBL970162 0.90 RARB (0.90) RARBMEN1ALDH1A1RARAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1990014672-A1 SUPERPARAMAGNETIC FLUIDS AND METHODS OF MAKING SUPERPARAMAGNETIC FLUIDS WYMAN JOHN E (US) 1990-11-29 WO claimed
US-5064550-A Magnetic particles coated with a fatty acid or an aminoalkyl carboxylic acid, hydrocarbon oil carrier, sealing CONSOLIDATED CHEMICAL CONSULTING CO. (US) 1991-11-12 US disclosed
WO-1990014672-A1 SUPERPARAMAGNETIC FLUIDS AND METHODS OF MAKING SUPERPARAMAGNETIC FLUIDS WYMAN JOHN E (US) 1990-11-29 WO disclosed