SCHEMBL9999560

SCHEMBL9999560

Nc1cc(N)cc(C(=O)NCc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 3/20 0.60
HDAC2 Q92769 2/20 0.60
HDAC8 Q9BY41 2/20 0.60
PLAU P00749 1/20 0.57
HPGD P15428 2/20 0.57
CA2 P00918 1/20 0.56
ALDH1A1 P00352 2/20 0.56
CFD P00746 1/20 0.56
LMNA P02545 1/20 0.55
RAB9A P51151 1/20 0.55
CYP2C19 P33261 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
TSHR P16473 1/20 0.54
HDAC1 Q13547 1/20 0.54
APOBEC3A P31941 1/20 0.54
CTDSP1 Q9GZU7 1/20 0.54
APOBEC3G Q9HC16 1/20 0.54
HPGDS O60760 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
SCHEMBL6094291 0.91 EGFR (0.59) HDAC6HDAC2HDAC8PLAUHPGD
SCHEMBL6094286 0.91 HDAC2 (0.54) HDAC6HDAC2HDAC8PLAUHPGD
SCHEMBL6093474 0.91 CFD (0.55) HDAC6HDAC2HDAC8PLAUHPGD
SCHEMBL23474248 0.89 GAA (0.62) HDAC6HDAC2HDAC8PLAUHPGD
SCHEMBL6093479 0.89 HDAC2 (0.53) HDAC6HDAC2HDAC8PLAUHPGD
SCHEMBL2915318 0.87 HDAC6 (0.74) HDAC6HDAC2HDAC8HPGDALDH1A1
SCHEMBL8395188 0.87 HDAC6 (0.69) HDAC6HDAC2HDAC8PLAUHPGD
SCHEMBL23511445 0.85 LMNA (0.68) HDAC6HDAC8CA2ALDH1A1LMNA
SCHEMBL6737728 0.84 HDAC6 (0.72) HDAC6HDAC2HDAC8HPGDCA2
SCHEMBL24587535 0.83 NR1H4 (0.61) HDAC6HDAC2HDAC8PLAUCA2

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
WO-2012014898-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学工業株式会社 (JP) 2012-02-02 WO disclosed