SCHEMBL3248784

SCHEMBL3248784

CCOC(=O)Oc1c[nH]c2c(=O)[nH]c3ccc(S(=O)(=O)Cc4ccccn4)cc3c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 1/20 0.34
KDM4E B2RXH2 3/20 0.34
GABRA1 P14867 2/20 0.34
GABRB2 P47870 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
POLB P06746 1/20 0.34
CYP2C9 P11712 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRA4 P48169 1/20 0.33

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
SCHEMBL3255978 0.87 FEN1 (0.39) KDM4EGABRA1GABRB2MEN1KMT2A
SCHEMBL3249084 0.87 JAK2 (0.39) KDM4EGABRA1GABRB2RAB9AGABRP
SCHEMBL3249826 0.86 KDM4E (0.35) KDM4EGABRA1GABRB2MEN1KMT2A
SCHEMBL3255432 0.83 MET (0.41) KDM4EMEN1KMT2APOLBCYP2C9
SCHEMBL3241840 0.82 KDM4E (0.41) KDM4EGABRA1GABRB2MEN1KMT2A
SCHEMBL3250557 0.81 MAPT (0.41) KDM4EMEN1KMT2APOLBCYP2C9
SCHEMBL3249036 0.81 TET2 (0.36) PARGKDM4EGABRA1GABRB2MEN1
SCHEMBL3247465 0.81 CRHBP (0.47) KDM4EMEN1KMT2APOLBCYP2C9
SCHEMBL3247431 0.80 MAPT (0.48) KDM4EMEN1KMT2APOLBCYP2C9
SCHEMBL3248591 0.80 TAS2R14 (0.43) KDM4EMEN1KMT2APOLBCYP2C9

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