SCHEMBL9319922

SCHEMBL9319922

CCOC(=O)CCC(=O)c1cnc2c(OC)cccc2c1NCc1ccccc1C

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ATP4A P20648 1/20 0.61
▸ ATP4B P51164 1/20 0.61
▸ KDM4E B2RXH2 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL9320011 0.89 KDM4E (0.64) ATP4AATP4BKDM4ESMN1; SMN2
Alcohol SCHEMBL11232169 0.86 KDM4E (0.68) ATP4AATP4BKDM4ESMN1; SMN2
SCHEMBL9318536 0.85 ATP4A (0.84) ATP4AATP4B
SCHEMBL11248284 0.82 KDM4E (0.72) KDM4ESMN1; SMN2
SCHEMBL9320767 0.79 MEN1 (0.53) ATP4AATP4B
SCHEMBL9319306 0.78 MEN1 (0.53) ATP4AATP4B
Bromide SCHEMBL11239162 0.78 ALDH1A1 (0.70) KDM4ESMN1; SMN2
SCHEMBL9319272 0.77 MEN1 (0.51) ATP4AATP4BKDM4E
SCHEMBL2017818 0.76 KDM4E (0.82) KDM4ESMN1; SMN2
SCHEMBL451221 0.76 ATP4A (1.00) ATP4AATP4B

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-5362743-A Aminoquinoline derivatives PFIZER INC. (US) 1994-11-08 — — US disclosed
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