SCHEMBL11924477

SCHEMBL11924477

O=C(Oc1ccccc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)Oc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 4/20 0.43
▸ MAOB P27338 1/20 0.42
▸ HDAC1 Q13547 2/20 0.42
▸ HDAC7 Q8WUI4 2/20 0.42
▸ HDAC8 Q9BY41 2/20 0.42
▸ HDAC6 Q9UBN7 2/20 0.42
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC9 Q9UKV0 1/20 0.42
▸ HDAC5 Q9UQL6 1/20 0.42
▸ ATM Q13315 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ HPGD P15428 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ CA1 P00915 1/20 0.39

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
SCHEMBL27845557 0.90 ELANE (0.42) ELANEMAOBATML3MBTL1TDP1
SCHEMBL19432834 0.89 ELANE (0.42) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL26061847 0.87 ELANE (0.47) ELANEMAOBATML3MBTL1TDP1
SCHEMBL10187806 0.86 ELANE (0.44) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL24360919 0.84 ELANE (0.45) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL1255890 0.81 ELANE (0.47) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL9086925 0.81 ELANE (0.41) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL544447 0.79 MAOB (0.49) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL10946374 0.79 ELANE (0.46) ELANEMAOBHDAC1HDAC2ATM
SCHEMBL7176961 0.78 ELANE (0.42) ELANEMAOBHDAC1HDAC2ATM

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
EP-2486923-B1 Histone deacetylase (HDAC) inhibiting compounds and method of making same FELIX JÄGER UND DR STEFAN DRINKUTH LABORGEMEINSCHAFT OHG DR (DE) 2015-09-09 — — EP disclosed
WO-2012107304-A1 HISTONE DEACETYLASE (HDAC) INHIBITING COMPOUNDS AND METHOD OF MAKING SAME Dr. Felix Jäger und Dr. Stefan Drinkuth Laborgemeinschaft OHG (DE) 2012-08-16 — — WO disclosed
EP-2486923-A1 Histone deacetylase (HDAC) inhibiting compounds and method of making same Dr. Felix Jäger und Dr. Stefan Drinkuth Laborgemeinschaft OHG (DE) 2012-08-15 — — EP disclosed
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