SCHEMBL9344644

SCHEMBL9344644

CCOCCSc1ccc(OC)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
KDM4E B2RXH2 1/20 0.50
MTNR1A P48039 1/20 0.50
MTNR1B P49286 1/20 0.50
HRH3 Q9Y5N1 1/20 0.50
APP P05067 1/20 0.46
NPC1 O15118 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
RAB9A P51151 3/20 0.45
TP53 P04637 1/20 0.45
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
DAO P14920 1/20 0.43
HPGD P15428 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42

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
SCHEMBL9348226 0.90 ALDH1A1 (0.54) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL18557906 0.87 ALDH1A1 (0.49) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL10345730 0.86 ALDH1A1 (0.51) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL418525 0.83 ALDH1A1 (0.59) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL10820381 0.83 ALDH1A1 (0.49) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL6123648 0.82 ALDH1A1 (0.54) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL7965895 0.81 ALDH1A1 (0.47) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL6512056 0.81 MTNR1A (0.51) ALDH1A1KDM4EMTNR1AMTNR1BHRH3
SCHEMBL10345911 0.81 NPC1 (0.58) ALDH1A1KDM4EMTNR1AMTNR1BNPC1
SCHEMBL10345795 0.81 NPC1 (0.58) ALDH1A1KDM4EMTNR1AMTNR1BNPC1

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
EP-0357409-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 1994-07-20 EP disclosed
EP-0357409-A2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed