SCHEMBL4807423

SCHEMBL4807423

NCCCCNC(=O)c1ccccc1C(=O)c1ccc(Cl)c(N)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 7/20 0.51
HDAC3 O15379 6/20 0.51
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 2/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL4812192 0.91 LMNA (0.51) HDAC1HDAC3LMNASMN1; SMN2POLB
SCHEMBL4807419 0.88 HDAC1 (0.49) HDAC1HDAC3LMNASMN1; SMN2POLB
SCHEMBL4808274 0.85 HTT (0.55) LMNASMN1; SMN2POLBALDH1A1KMT2A
SCHEMBL4805173 0.84 HDAC1 (0.53) HDAC1HDAC3LMNASMN1; SMN2ALDH1A1
SCHEMBL4801474 0.83 HDAC1 (0.55) HDAC1HDAC3LMNASMN1; SMN2ALDH1A1
SCHEMBL13754013 0.83 KDM4E (0.51) HDAC1LMNASMN1; SMN2POLBALDH1A1
SCHEMBL4812181 0.81 ALDH1A1 (0.49) HDAC1HDAC3LMNASMN1; SMN2POLB
SCHEMBL4801436 0.79 MAPT (0.50) HDAC1HDAC3LMNASMN1; SMN2ALDH1A1
SCHEMBL30843288 0.79 HTT (0.65) HDAC1HDAC3SMN1; SMN2POLBHPGD
SCHEMBL8515238 0.76 ALDH1A1 (0.57) HDAC1HDAC3LMNASMN1; SMN2ALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7427260-B2 Efficient methods for solid phase synthesis using trityl chloride resins MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2008-09-23 US disclosed
US-20040096904-A1 Efficient methods for solid phase synthesis using trityl chloride resins MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2004-05-20 US disclosed
WO-2002079278-A1 EFFICIENT METHODS FOR SOLID PHASE SYNTHESIS USING TRITYL CHLORIDE RESINS MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2002-10-10 WO disclosed