SCHEMBL14817461

SCHEMBL14817461

CC(=O)OCCCSSc1ccccn1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 13/20 0.45
HDAC2 Q92769 13/20 0.45
LMNA P02545 1/20 0.45
EHMT2 Q96KQ7 1/20 0.43
EHMT1 Q9H9B1 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
ALDH1A1 P00352 2/20 0.42
PTGS2 P35354 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL17253259 0.92 LMNA (0.47) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL28255049 0.87 HDAC1 (0.48) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL3093190 0.87 HDAC1 (0.46) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL2738376 0.86 LMNA (0.49) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL23336313 0.86 HDAC1 (0.45) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL686399 0.84 HDAC1 (0.42) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL26553894 0.84 HDAC1 (0.41) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL3099655 0.83 HDAC1 (0.47) HDAC1HDAC2LMNAEHMT2EHMT1
SCHEMBL24177495 0.82 HDAC1 (0.52) HDAC1HDAC2LMNASMN1; SMN2
SCHEMBL10086904 0.81 ALDH1A1 (0.49) HDAC1HDAC2LMNAEHMT2EHMT1

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-8404222-B2 Soluble, degradable poly(ethylene glycol) derivatives for controllable release of bound molecules into solution NEKTAR THERAPEUTICS (US) 2013-03-26 US disclosed