SCHEMBL7787066

SCHEMBL7787066

CN1c2ccccc2C(C(=O)O)c2c(-c3cc(F)cc(F)c3)cccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
EGFR P00533 2/20 0.38
SRC P12931 1/20 0.38
PSEN1 P49768 8/20 0.36
PSEN2 P49810 8/20 0.36
APH1B Q8WW43 8/20 0.36
NCSTN Q92542 8/20 0.36
APH1A Q96BI3 8/20 0.36
PSENEN Q9NZ42 8/20 0.36
SPPL2A Q8TCT8 1/20 0.36
CHRM3 P20309 4/20 0.35
CCKBR P32239 1/20 0.35
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL2218310 0.87 HDAC4 (0.50) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL7796571 0.82 HDAC4 (0.46) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL8876764 0.81 HDAC4 (0.43) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL3772653 0.81 HDAC4 (0.44) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL7793163 0.78 HDAC4 (0.44) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL5665141 0.78 HDAC4 (0.44) HDAC4HDAC7HDAC5MEN1KMT2A
Acridan SCHEMBL7793226 0.78 HDAC4 (0.36) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL31613807 0.75 HDAC4 (0.66) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL2989515 0.75 HDAC4 (0.66) HDAC4HDAC7HDAC5MEN1KMT2A
SCHEMBL7752463 0.74 HDAC4 (0.43) HDAC4HDAC7HDAC5MEN1KMT2A

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-0750748-B1 NOVEL ARYL N-ALKYLACRIDANCARBOXYLATE DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN INC (US) 2001-12-05 EP claimed
US-5593845-A BY REACTION WITH PEROXIDES AND PEROXIDASE; DETECTION OF HAPTENS, PROTEINS, ANTIBODIES IN ENZYME IMMUNOASSAY LUMIGEN, INC. (US) 1997-01-14 US disclosed