SCHEMBL30770947

SCHEMBL30770947

O=Cc1cc2[nH]c(=O)oc2cc1[N+](=O)[O-]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.44
CYP3A4 P08684 2/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ALOX15 P16050 1/20 0.43
PRKDC P78527 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 2/20 0.39
CYP1A2 P05177 2/20 0.39
TSHR P16473 2/20 0.39
BLM P54132 2/20 0.39
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
HPGD P15428 1/20 0.39
GRIK1 P39086 1/20 0.39
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39

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
SCHEMBL1027569 0.80 NOS1 (0.49) KMOCYP3A4MAPTKDM4EALDH1A1
SCHEMBL6963040 0.78 KMO (0.64) KMOCYP3A4MAPTALDH1A1LMNA
SCHEMBL25260021 0.78 KMO (0.46) KMOCYP3A4MAPTALDH1A1LMNA
SCHEMBL6970927 0.78 KMO (0.46) KMOCYP3A4MAPTALDH1A1LMNA
SCHEMBL17320650 0.76 MAPT (0.49) CYP3A4MAPTKDM4EALDH1A1ALOX15
SCHEMBL10504041 0.75 KMO (0.46) KMOCYP3A4MAPTALDH1A1ALOX15
SCHEMBL25289763 0.75 KMO (0.46) KMOCYP3A4MAPTALDH1A1ALOX15
SCHEMBL30483748 0.75 KMO (0.46) KMOCYP3A4MAPTALDH1A1ALOX15
SCHEMBL4812924 0.75 KMO (0.46) KMOCYP3A4MAPTALDH1A1ALOX15
SCHEMBL31667159 0.71 GRIA1 (0.56) KMOMAPTKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4561563-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF Ensem Therapeutics, Inc. (US) 2025-06-04 EP disclosed
CN-119947718-A Tricyclic aryl derivatives, and compositions and methods thereof 昂胜医疗科技公司 2025-05-06 CN disclosed
WO-2024026129-A2 TRICYCLIC ARYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed