SCHEMBL7656457

SCHEMBL7656457

O=C(NCc1ccccc1)c1ccc(N(C(=O)Cc2ccccc2)C(=O)Cc2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.60
HDAC2 Q92769 3/20 0.60
HDAC8 Q9BY41 3/20 0.60
HPGD P15428 1/20 0.57
LMNA P02545 1/20 0.56
RAB9A P51151 1/20 0.56
HDAC1 Q13547 6/20 0.55
HDAC3 O15379 2/20 0.54
HDAC4 P56524 2/20 0.54
HDAC7 Q8WUI4 2/20 0.54
HDAC10 Q969S8 2/20 0.54
HDAC11 Q96DB2 2/20 0.54
HDAC9 Q9UKV0 2/20 0.54
HDAC5 Q9UQL6 2/20 0.54
ROCK2 O75116 1/20 0.54
RPS6KA5 O75582 1/20 0.54
MAP4K4 O95819 1/20 0.54
PRKCG P05129 1/20 0.54
PRKACA P17612 1/20 0.54
RPS6KB1 P23443 1/20 0.54

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
SCHEMBL673384 0.85 HDAC6 (0.63) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL11900090 0.82 HDAC6 (0.85) HDAC6HDAC2HDAC8HPGDLMNA
SCHEMBL7657647 0.81 SRD5A2 (0.54) HDAC6HDAC2HDAC8HDAC1HDAC3
SCHEMBL457082 0.79 HDAC6 (0.79) HDAC6HDAC2HDAC8HPGDLMNA
SCHEMBL6843720 0.77 HDAC6 (0.77) HDAC6HDAC2HDAC8HPGDLMNA
SCHEMBL4747957 0.77 NR1H4 (0.81) HDAC6HDAC2HDAC8HPGDLMNA
Hydrochloric Acid SCHEMBL3757721 0.77 HDAC6 (0.76) HDAC6HDAC2HDAC8HPGDLMNA
SCHEMBL29184442 0.77 HDAC6 (0.76) HDAC6HDAC2HDAC8HPGDLMNA
SCHEMBL7147935 0.77 HDAC6 (0.66) HDAC6HDAC2HDAC8HPGDLMNA
SCHEMBL539059 0.76 EPHX2 (0.84) HDAC6HDAC2HDAC8HPGDLMNA

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-6407120-B1 ADMINISTERING PYRIDINYLACETAMIDE OR PHENYLACETAMIDE DERIVATIVE TO TREAT CARDIOVASCULAR, EATING, SEXUAL, BRAIN, NERVOUS SYSTEM, GASTROINTESTINAL, UROGENITAL, PSYCHOLOGICAL, AND RESPIRATORY SYSTEM DISORDERS PFIZER INC. 2002-06-18 US disclosed