SCHEMBL31349474

SCHEMBL31349474

O=[N+]([O-])c1ccc2nc(N3CCCCC3)oc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
RAB9A P51151 4/20 0.52
NPC1 O15118 3/20 0.52
APOBEC3A P31941 1/20 0.52
APOBEC3G Q9HC16 1/20 0.52
SMN1; SMN2 Q16637 4/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 3/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GPR119 Q8TDV5 2/20 0.50
ACHE P22303 1/20 0.49
NPBWR1 P48145 3/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46
MMP13 P45452 1/20 0.46
LMNA P02545 1/20 0.46
ALOX12 P18054 1/20 0.46

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
SCHEMBL31349462 0.99 NPC1 (0.53) GAARAB9ANPC1APOBEC3AAPOBEC3G
SCHEMBL25598124 0.89 RAB9A (0.57) GAARAB9ANPC1APOBEC3AAPOBEC3G
SCHEMBL14811034 0.88 ALDH1A1 (0.52) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL6488937 0.87 APP (0.50) GAARAB9ANPC1APOBEC3AAPOBEC3G
SCHEMBL31349431 0.87 ALDH1A1 (0.58) RAB9ANPC1SMN1; SMN2ALDH1A1MAPT
SCHEMBL31349367 0.84 RAB9A (0.46) GAARAB9ANPC1APOBEC3AAPOBEC3G
SCHEMBL31349363 0.83 RAB9A (0.44) GAARAB9ANPC1APOBEC3AAPOBEC3G
SCHEMBL31349374 0.83 RAB9A (0.44) GAARAB9ANPC1APOBEC3AAPOBEC3G
SCHEMBL31349398 0.83 RAB9A (0.44) GAARAB9ANPC1APOBEC3AAPOBEC3G
SCHEMBL31349437 0.83 RAB9A (0.59) GAARAB9ANPC1SMN1; SMN2ALDH1A1

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
EP-4737445-A1 NOVEL SATURATED HETEROCYCLE-SUBSTITUTED HETEROARYL-CARBONOHYDRAZONOYL DICYANIDE COMPOUND AND USE THEREOF Korea Institute of Science and Technology (KR) 2026-05-06 EP disclosed
WO-2025005367-A1 NOVEL SATURATED HETEROCYCLE-SUBSTITUTED HETEROARYL-CARBONOHYDRAZONOYL DICYANIDE COMPOUND AND USE THEREOF 한국과학기술연구원 2025-01-02 WO disclosed