SCHEMBL3250282

SCHEMBL3250282

O=C(O)CCNC(=O)c1c[nH]c2c(=O)[nH]c3ccccc3c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 1/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
RAB9A P51151 3/20 0.44
POLB P06746 2/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
NPC1 O15118 1/20 0.44
PKM P14618 1/20 0.44
HDAC1 Q13547 2/20 0.43
HDAC2 Q92769 2/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43

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
SCHEMBL4153802 0.93 PPARG (0.47) ADAM17KDM4EALDH1A1RAB9APOLB
SCHEMBL4761696 0.88 KDM4E (0.48) ADAM17KDM4EALDH1A1POLBKMT2A
SCHEMBL3249528 0.88 SMN1; SMN2 (0.43) KDM4EALDH1A1RAB9APOLBKMT2A
SCHEMBL3241767 0.86 ALDH1A1 (0.51) KDM4EALDH1A1RAB9APOLBKMT2A
SCHEMBL14624976 0.86 RAB9A (0.44) KDM4EALDH1A1RAB9APOLBKMT2A
SCHEMBL14624983 0.86 ALDH1A1 (0.41) KDM4EALDH1A1RAB9APOLBKMT2A
SCHEMBL3252625 0.86 KDM4E (0.58) KDM4EALDH1A1RAB9APOLBKMT2A
SCHEMBL3245362 0.84 PARP1 (0.50) KDM4EALDH1A1RAB9APOLBKMT2A
SCHEMBL3241785 0.83 MEN1 (0.63) RAB9APOLBKMT2AMEN1NPC1
SCHEMBL3248405 0.82 KDM4E (0.54) KDM4EALDH1A1POLBKMT2AMEN1

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 4 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
EP-1899335-A1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2008-03-19 EP disclosed
WO-2007003611-A1 PYRROLOQUINOLINE DERIVATIVES AND THEIR USE AS PROTEIN KINASE INHIBITORS PIERRE FABRE MEDICAMENT (FR) 2007-01-11 WO disclosed