SCHEMBL30159613

SCHEMBL30159613

CCOc1ccccc1[N+](=O)[O-]

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.79
LMNA P02545 2/20 0.79
RAB9A P51151 5/20 0.72
NPC1 O15118 4/20 0.72
RECQL P46063 2/20 0.72
KMT2A Q03164 6/20 0.68
MEN1 O00255 3/20 0.68
MAPT P10636 1/20 0.68
MAPK1 P28482 1/20 0.68
TDP1 Q9NUW8 1/20 0.63
HTT P42858 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.59
L3MBTL1 Q9Y468 3/20 0.56
KDM4E B2RXH2 2/20 0.55
GAA P10253 1/20 0.55
POLB P06746 1/20 0.54

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
SCHEMBL2436211 1.00 ALDH1A1 (0.79) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL10507215 0.98 ALDH1A1 (0.77) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL10507211 0.98 ALDH1A1 (0.77) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL29151237 0.95 ALDH1A1 (0.72) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL10507447 0.92 ALDH1A1 (0.68) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL11248634 0.90 ALDH1A1 (0.67) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL14601545 0.87 ALDH1A1 (0.63) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL5678530 0.86 ALDH1A1 (0.61) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL3464612 0.85 NPC1 (0.79) ALDH1A1LMNARAB9ANPC1RECQL
SCHEMBL11452281 0.84 ALDH1A1 (0.83) ALDH1A1LMNARAB9ANPC1RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119404099-A Systems and methods for a digital, multiplexed, extracellular vesicle-derived biomarker diagnostic lab-on-a-chip 埃克斯科瑞克斯公司 2025-02-07 CN disclosed
WO-2025018312-A1 ELECTROLYTIC SOLUTION FOR ELECTRIC DOUBLE LAYER CAPACITOR AND ELECTRIC DOUBLE LAYER CAPACITOR 日本ケミコン株式会社 2025-01-23 WO disclosed
CN-118324611-A Novel method for efficiently synthesizing phenylalkyl ether 江苏惠利生物科技有限公司 2024-07-12 CN disclosed
WO-2023275198-A1 COMPOSITION COMPRISING AN ALKANOLAMINE, A (META)SILICATE, GLYCINE, A DYE AND A POLYSACCHARIDE L'OREAL (FR) 2023-01-05 WO disclosed