SCHEMBL13265348

SCHEMBL13265348

CC(=O)c1cccc(OC(F)F)c1C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 5/20 0.42
LMNA P02545 4/20 0.42
HTT P42858 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALPL P05186 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.41
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
NR1I2 O75469 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 1/20 0.39
GAA P10253 1/20 0.39
TAS2R14 Q9NYV8 1/20 0.38
EZH2 Q15910 1/20 0.38

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
SCHEMBL16950338 0.86 GAA (0.40) KMT2AALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL1286684 0.84 IRAK4 (0.53) KMT2AALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL29867597 0.83 KMT2A (0.46) KMT2AALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL26914818 0.83 KMT2A (0.46) KMT2AALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2481524 0.81 KMT2A (0.42) KMT2AALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL18257237 0.79 DRD1 (0.39) KMT2AALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL698393 0.78 LMNA (0.53) KMT2ALMNAHTTSMN1; SMN2MAPT
SCHEMBL15108831 0.76 KDM4E (0.47) KMT2AALDH1A1HTTSMN1; SMN2KDM4E
SCHEMBL27933650 0.75 IRAK4 (0.56) KMT2AALDH1A1LMNAMAPTTDP1
SCHEMBL21132607 0.74 TSHR (0.37) KMT2AALDH1A1LMNASMN1; SMN2KDM4E

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-2010074088-A1 CYCLIC AMINE COMPOUNDS 第一三共株式会社 (JP) 2010-07-01 WO disclosed