SCHEMBL7201251

SCHEMBL7201251

CN(C)c1cccc2c1c(O)c(C(=O)N(C)c1cc(F)ccc1F)c(=O)n2C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.48
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
PGR P06401 1/20 0.44
ALDH1A1 P00352 5/20 0.42
MAPT P10636 3/20 0.42
KDM4E B2RXH2 3/20 0.42
NPC1 O15118 3/20 0.40
THRB P10828 1/20 0.39
HTR1A P08908 1/20 0.35
HTR2A P28223 1/20 0.35
HTR7 P34969 1/20 0.35
HTR6 P50406 1/20 0.35
HPGD P15428 1/20 0.35
CRHBP P24387 1/20 0.35
CRHR2 Q13324 1/20 0.35
NLRP3 Q96P20 1/20 0.35
POLB P06746 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
RAB9A P51151 1/20 0.34

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
SCHEMBL5164306 0.89 HDAC4 (0.48) HDAC4MEN1KMT2APGRMAPT
SCHEMBL5163897 0.88 HDAC4 (0.64) HDAC4MEN1KMT2APGRALDH1A1
SCHEMBL7614121 0.87 HDAC4 (0.46) HDAC4MEN1KMT2APGRALDH1A1
SCHEMBL7558207 0.86 HDAC4 (0.46) HDAC4MEN1KMT2APGRALDH1A1
SCHEMBL7722661 0.86 HDAC4 (0.46) HDAC4MEN1KMT2APGRALDH1A1
SCHEMBL4498207 0.80 HDAC4 (0.39) HDAC4MEN1KMT2APGRALDH1A1
SCHEMBL1573840 0.80 HDAC4 (0.48) HDAC4MEN1KMT2APGRMAPT
SCHEMBL10675692 0.80 KMT2A (0.68) HDAC4MEN1KMT2APGRALDH1A1
SCHEMBL5163474 0.80 HDAC4 (0.64) HDAC4MEN1KMT2APGRMAPT
SCHEMBL5165679 0.80 HDAC4 (0.47) HDAC4MEN1KMT2APGRALDH1A1

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-6605616-B1 Autoimmune diseases; inflammation ACTIVE BIOTECH AB (SE) 2003-08-12 US disclosed