SCHEMBL26527709

SCHEMBL26527709

CCc1nc2nc(C)ccn2c1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
GABRA4 P48169 1/20 0.37
GABRE P78334 1/20 0.37
GABRA6 Q16445 1/20 0.37
GABRG1 Q8N1C3 1/20 0.37
GABRG3 Q99928 1/20 0.37
GABRQ Q9UN88 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 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
SCHEMBL23099644 0.85 GABRP (0.39) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL26527665 0.84 MAPK1 (0.50) KMT2AMEN1NPC1RAB9AMAPK1
SCHEMBL22623466 0.80 ESR1 (0.36) PARP1MAPK1KDM4EALDH1A1HSD17B10
SCHEMBL24689506 0.78 GABRP (0.34) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL22623459 0.77 LMNA (0.43) KMT2AMEN1RAB9AMAPK1KDM4E
SCHEMBL23099608 0.76 KDM4E (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23099510 0.75 DPP4 (0.32) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23099556 0.73 KDM4E (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL23099646 0.73 GABRP (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL26527736 0.73 KDM4E (0.40) MAPK1KDM4EALDH1A1HSD17B10HPGD

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-2024089170-A1 ANTIBACTERIAL COMPOUNDS Janssen Sciences Ireland Unlimited Company (IE) 2024-05-02 WO disclosed
WO-2023073090-A1 IMIDAZOPYRIDINE AMIDES AND RELATED COMPOUNDS FOR USE IN THE TREATMENT OF BACTERIAL INFECTIONS Janssen Sciences Ireland Unlimited Company (IE) 2023-05-04 WO disclosed