SCHEMBL10954256

SCHEMBL10954256

Cc1ccc(CCC(=O)Nc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
ATM Q13315 1/20 0.59
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA9 Q16790 1/20 0.58
MAPT P10636 1/20 0.57
HTT P42858 1/20 0.57
GAA P10253 2/20 0.56
HDAC3 O15379 2/20 0.56
HDAC4 P56524 2/20 0.56
HDAC1 Q13547 2/20 0.56
HDAC7 Q8WUI4 2/20 0.56
HDAC2 Q92769 2/20 0.56
HDAC10 Q969S8 2/20 0.56
HDAC11 Q96DB2 2/20 0.56
HDAC8 Q9BY41 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
HDAC9 Q9UKV0 2/20 0.56

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
SCHEMBL1471759 0.86 MAPT (0.77) MEN1KMT2AMAPTHTTGAA
SCHEMBL2003074 0.86 MAPT (0.77) MEN1KMT2AMAPTHTTGAA
SCHEMBL7566765 0.86 MAPT (0.77) MEN1KMT2AMAPTHTTGAA
SCHEMBL13389060 0.86 MAPT (0.77) MEN1KMT2AMAPTHTTGAA
SCHEMBL10953379 0.85 HDAC1 (0.62) MEN1KMT2AMAPTHTTGAA
SCHEMBL13776958 0.84 HDAC2 (0.59) MEN1KMT2AATMMAPTHTT
SCHEMBL10954317 0.84 KMT2A (0.71) MEN1KMT2ACA1CA2MAPT
SCHEMBL12345556 0.83 MEN1 (0.67) MEN1KMT2AATMMAPTHTT
SCHEMBL1565360 0.82 SELL (0.66) MEN1KMT2AFFAR1
SCHEMBL27160281 0.82 NPY5R (0.77) MEN1KMT2AMAPTHTTGAA

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
US-4536346-A TREATMENT OF ATHEROSCLEROSIS AMERICAN CYANAMID COMPANY (US) 1985-08-20 US disclosed
EP-0124791-A1 Aralkanamidophenyl compounds AMERICAN CYANAMID COMPANY (US) 1984-11-14 EP disclosed