SCHEMBL10692924

SCHEMBL10692924

Brc1ccc2cnc3c(c2c1)NCCC3

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 6/20 0.38
▸ BCHE P06276 5/20 0.38
▸ GRIN1 Q05586 5/20 0.38
▸ GRIN2A Q12879 5/20 0.38
▸ PLG P00747 1/20 0.35
▸ PLAU P00749 1/20 0.35
▸ PLAT P00750 1/20 0.35
▸ NCF1 P14598 1/20 0.33
▸ MAP3K14 Q99558 1/20 0.33
▸ NOS1 P29475 2/20 0.33
▸ METAP2 P50579 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ CSNK2A1 P68400 1/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32
▸ SPR P35270 1/20 0.32
▸ CHUK O15111 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL10377659 0.82 ACHE (0.38) ACHEBCHEGRIN1GRIN2A
SCHEMBL10378822 0.79 PARP1 (0.47) ACHEBCHEGRIN1GRIN2APLAU
SCHEMBL10377744 0.78 KDM4E (0.39) ACHEBCHEGRIN1GRIN2ACYP1A2
SCHEMBL10688754 0.76 KDM4E (0.37) ACHEHTTMAPTMAP4K1
SCHEMBL10685831 0.75 CYP19A1 (0.35) CSNK2A1DYRK1AMAPTFLT3AHR
SCHEMBL10379456 0.73 KMT2A (0.38) ACHEBCHEGRIN1GRIN2AMAP4K1
SCHEMBL10379440 0.73 ACHE (0.38) ACHEBCHEGRIN1GRIN2ANOS1
SCHEMBL10687008 0.73 ACHE (0.38) ACHEBCHEGRIN1GRIN2AMAP4K1
SCHEMBL19629535 0.69 KDM4E (0.42) PLAUNCF1NOS1CYP1A2
SCHEMBL21828348 0.67 MAP4K1 (0.36) MAP4K1

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
US-4742061-A Benzoc[c]-1,5-naphthyridines and related compounds as memory enhancing agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-05-03 — — US claimed
US-4742061-A Benzoc[c]-1,5-naphthyridines and related compounds as memory enhancing agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-05-03 — — US disclosed
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