SCHEMBL5317072

SCHEMBL5317072

Oc1ccccc1Oc1cnccn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
MEN1 O00255 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.44
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 3/20 0.42
POLB P06746 1/20 0.42
JAK2 O60674 1/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 2/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
TP53 P04637 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PLAU P00749 1/20 0.36
LTA4H P09960 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL5334067 0.79 KDM4E (0.56) KMT2AMEN1KDM4EMAPTGAA
SCHEMBL2464288 0.79 KMT2A (0.50) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL5322990 0.77 SMN1; SMN2 (0.50) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL29064573 0.77 HTT (0.49) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL30749441 0.75 GAA (0.41) KMT2AMEN1KDM4EMAPTGAA
SCHEMBL5322772 0.75 KDM4E (0.54) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL2566401 0.75 KMT2A (0.47) KMT2AMEN1SMN1; SMN2KDM4EMAPT
Hydrochloric Acid SCHEMBL3768593 0.73 MEN1 (0.46) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL11824328 0.73 TSHR (0.55) KMT2AMEN1SMN1; SMN2KDM4EMAPT
SCHEMBL2492070 0.73 KDM4E (0.53) KMT2AMEN1SMN1; SMN2KDM4EMAPT

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-2007079173-A2 NOVEL 2-HETEROARYLOXY-PHENOL DERIVATIVES AS ANTIBACTERIAL AGENTS EMERGENT BIOSOLUTIONS INC. (US) 2007-07-12 WO disclosed