SCHEMBL10483546

SCHEMBL10483546

Nc1cc(C(=O)Nc2ncnc(-c3cccc4ccccc34)n2)ccn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.45
▸ SIRT2 Q8IXJ6 1/20 0.40
▸ HDAC8 Q9BY41 2/20 0.40
▸ HDAC6 Q9UBN7 2/20 0.40
▸ GABRP O00591 1/20 0.40
▸ GABRD O14764 1/20 0.40
▸ GABRA1 P14867 1/20 0.40
▸ GABRB1 P18505 1/20 0.40
▸ GABRG2 P18507 1/20 0.40
▸ GABRB3 P28472 1/20 0.40
▸ GABRA5 P31644 1/20 0.40
▸ GABRA3 P34903 1/20 0.40
▸ GABRA2 P47869 1/20 0.40
▸ GABRB2 P47870 1/20 0.40
▸ GABRA4 P48169 1/20 0.40
▸ GABRE P78334 1/20 0.40
▸ GABRA6 Q16445 1/20 0.40
▸ GABRG1 Q8N1C3 1/20 0.40
▸ GABRG3 Q99928 1/20 0.40
▸ GABRQ Q9UN88 1/20 0.40

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
SCHEMBL9566410 0.85 HDAC1 (0.42) LMNASIRT2HDAC8HDAC6GABRP
SCHEMBL9566459 0.85 JAK2 (0.45) LMNAHDAC8HDAC6GABRPGABRD
SCHEMBL10822461 0.84 MEN1 (0.44) LMNAHDAC1MAPTKDM4EKMT2A
SCHEMBL10483438 0.83 NPC1 (0.40) SIRT2HDAC8HDAC6GABRPGABRD
SCHEMBL10483371 0.83 JAK2 (0.41) LMNASIRT2HDAC8HDAC6GABRP
SCHEMBL10483372 0.83 HDAC1 (0.41) SIRT2HDAC8HDAC6GABRPGABRD
SCHEMBL9566552 0.82 GABRP (0.48) LMNASIRT2HDAC8HDAC6GABRP
SCHEMBL10483353 0.81 SIRT2 (0.55) SIRT2TP53KDM4EKMT2ANPC1
SCHEMBL9566563 0.79 TYK2 (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10483488 0.77 L3MBTL1 (0.45) LMNAHDAC8GABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4874762-A TREATING DEMENTIA NIPPON SHINYAKU CO., LTD. (JP) 1989-10-17 — — US claimed
US-4593025-A A 2-naphthyl-4,6-diamino-s-triazine compound NIPPON SHINYAKU CO., LTD. (JP) 1986-06-03 — — US claimed
US-4554275-A Triazine derivatives NIPPON SHINYAKU CO., LTD. (JP) 1985-11-19 — — US claimed
US-4874762-A TREATING DEMENTIA NIPPON SHINYAKU CO., LTD. (JP) 1989-10-17 — — US disclosed
US-4593025-A A 2-naphthyl-4,6-diamino-s-triazine compound NIPPON SHINYAKU CO., LTD. (JP) 1986-06-03 — — US disclosed
US-4554275-A Triazine derivatives NIPPON SHINYAKU CO., LTD. (JP) 1985-11-19 — — US disclosed
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