SCHEMBL31648976

SCHEMBL31648976

CCOC(=O)c1c(=O)c2cnc(N3CC4CNCC4C3)nc2n2c1sc1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 2/20 0.34
GABRB2 P47870 2/20 0.34
GABRA4 P48169 2/20 0.34
GABRE P78334 2/20 0.34
GABRA6 Q16445 2/20 0.34
GABRG1 Q8N1C3 2/20 0.34
GABRG3 Q99928 2/20 0.34
GABRQ Q9UN88 2/20 0.34
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
CDK4 P11802 3/20 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
SCHEMBL31649275 1.00 KDM4E (0.36) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL31649133 0.92 KDM4E (0.32) KDM4ETDP1
SCHEMBL31737401 0.91 KDM4E (0.37) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL31737397 0.91 KDM4E (0.36) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL31737567 0.89 GRK6 (0.37) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL31649114 0.89 KDM4E (0.35) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL31649112 0.88 MAPT (0.37) KDM4EADRB2ADRB1HCRTR1HCRTR2
SCHEMBL31737838 0.88 CAMK2D (0.36) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL31649208 0.86 KDM4E (0.37) KDM4EGABRPGABRDGABRA1GABRB1
SCHEMBL31649019 0.86 RXFP1 (0.43) KDM4EMEN1POLBKMT2APTPN11

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
WO-2025242908-A2 NOVEL COMPOUNDS GENOME THERAPEUTICS LTD (GB) 2025-11-27 WO disclosed
WO-2025133338-A1 QUINOLONE DERIVATVES AGAINST CANCER GENOME THERAPEUTICS LTD (GB) 2025-06-26 WO disclosed