SCHEMBL14724569

SCHEMBL14724569

CCOC(=O)c1ccc(C#Cc2ccc(C(N)=O)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP3A4 P08684 1/20 0.59
MAOA P21397 1/20 0.59
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA12 O43570 2/20 0.56
CA7 P43166 2/20 0.56
CA9 Q16790 2/20 0.56
CA14 Q9ULX7 2/20 0.56
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56
PARP10 Q53GL7 1/20 0.54
STS P08842 1/20 0.50
NOS3 P29474 2/20 0.49
NOS1 P29475 2/20 0.49
NOS2 P35228 2/20 0.49
HPGD P15428 4/20 0.49
HTT P42858 2/20 0.49
MMP2 P08253 1/20 0.47

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
SCHEMBL6365625 0.91 CA1 (0.66) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL6896360 0.89 LMNA (0.71) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL3639721 0.85 MEN1 (0.59) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL18400673 0.85 LMNA (0.61) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL10411225 0.84 CA1 (0.61) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL18399494 0.83 LMNA (0.62) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL14786695 0.82 MAPT (0.58) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL18712211 0.81 CA1 (0.58) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL23582927 0.81 PARP10 (0.66) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL9425628 0.81 RARB (0.61) LMNACYP1A2CYP3A4MAOACA1

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
EP-2562155-A1 NOVEL HYDROXAMIC ACID DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2013-02-27 EP disclosed