SCHEMBL3249273

SCHEMBL3249273

CCOC(=O)N(CC)S(=O)(=O)c1ccc2[nH]c(=O)c3[nH]cc(C(=O)O)c3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.42
HSD17B10 Q99714 8/20 0.42
POLB P06746 6/20 0.42
KMT2A Q03164 4/20 0.42
MEN1 O00255 3/20 0.42
CYP2C9 P11712 1/20 0.42
ADRB2 P07550 1/20 0.41
RECQL P46063 1/20 0.41
MAPT P10636 8/20 0.41
RXFP1 Q9HBX9 1/20 0.40
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 7/20 0.39
USP2 O75604 3/20 0.39
ESR1 P03372 1/20 0.39
ALDH1A1 P00352 6/20 0.39
LMNA P02545 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37

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
SCHEMBL3244578 0.93 MAPT (0.41) KDM4EHSD17B10POLBKMT2AMEN1
SCHEMBL3248232 0.82 HSD17B10 (0.47) KDM4EHSD17B10POLBKMT2AMEN1
SCHEMBL3249025 0.81 MAPT (0.52) KDM4EHSD17B10KMT2AMEN1ADRB2
SCHEMBL3241807 0.80 KDM4E (0.48) KDM4EHSD17B10POLBKMT2AMEN1
SCHEMBL3248331 0.80 KDM4E (0.60) KDM4EHSD17B10POLBKMT2AMEN1
SCHEMBL3247632 0.79 KMT2A (0.58) KDM4EHSD17B10KMT2AMEN1ADRB2
SCHEMBL3250948 0.79 KDM4E (0.46) KDM4EHSD17B10POLBKMT2AMEN1
SCHEMBL3247255 0.79 RXFP1 (0.42) KDM4EHSD17B10POLBKMT2AMEN1
SCHEMBL3249264 0.78 POLB (0.49) KDM4EHSD17B10POLBKMT2AMEN1
SCHEMBL3254539 0.78 MAPT (0.48) KDM4EHSD17B10POLBKMT2AMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP claimed
EP-1899335-B1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PF MEDICAMENT (FR) 2010-05-19 EP disclosed