SCHEMBL11215744

SCHEMBL11215744

[NH]C(=O)C(C(=O)O)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.46
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ALDH1A1 P00352 2/20 0.38
ALPG P10696 2/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.38
HPGD P15428 2/20 0.38

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
SCHEMBL3710055 0.87 SRC (0.61) SRCHDAC3HDAC4HDAC1HDAC7
SCHEMBL8126791 0.81 SRC (0.48) SRCCES2LMNAALDH1A1HPGD
SCHEMBL351263 0.81 SRC (0.48) SRCHDAC3HDAC4HDAC1HDAC7
SCHEMBL8127110 0.80 SRC (0.73) SRCHDAC3HDAC4HDAC1HDAC7
SCHEMBL7821350 0.79 SRC (0.46) SRCHDAC3HDAC4HDAC1HDAC7
SCHEMBL11212236 0.79 SRC (0.46) SRCCES2CES1LMNASMN1; SMN2
SCHEMBL11217372 0.79 SRC (0.46) SRCLMNASMN1; SMN2ALDH1A1HTT
SCHEMBL11215807 0.79 SRC (0.46) SRCHDAC4HDAC7HDAC5LMNA
SCHEMBL11212846 0.77 HDAC3 (0.44) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11210088 0.75 RAB9A (0.51) CES2CES1ALDH1A1NPSR1

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-4329454-A Cephalosporin compounds ELI LILLY AND COMPANY (US) 1982-05-11 US disclosed