SCHEMBL3460086

SCHEMBL3460086

c1ccc(NOc2ccccc2ONc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
TDP1 Q9NUW8 4/20 0.43
HSD17B10 Q99714 3/20 0.43
CTSD P07339 1/20 0.43
TSHR P16473 3/20 0.41
PTGS2 P35354 2/20 0.41
ALOX12 P18054 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALOX15 P16050 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
MAPK1 P28482 1/20 0.41
HTR2B P41595 1/20 0.41
CYP3A4 P08684 3/20 0.39
IDO1 P14902 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
LMNA P02545 1/20 0.39
CYP2D6 P10635 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
SCHEMBL11332939 0.84 TDP1 (0.35) ALDH1A1TDP1HSD17B10CTSDTSHR
SCHEMBL9417471 0.84 SMN1; SMN2 (0.41) ALDH1A1TDP1CTSDTSHRL3MBTL1
SCHEMBL6510356 0.84 NOTUM (0.46) TSHRALOX15SLC6A2HTR2BCYP3A4
SCHEMBL28383789 0.84 TDP1 (0.44) ALDH1A1TDP1HSD17B10CTSDTSHR
SCHEMBL7714930 0.82 MAPT (0.52) ALDH1A1TDP1L3MBTL1MAPK1LMNA
SCHEMBL7870365 0.80 ALDH1A1 (0.47) ALDH1A1TDP1HSD17B10TSHRALOX15
SCHEMBL10535670 0.79 MEN1 (0.41) ALDH1A1TDP1TSHRSLC6A2CYP3A4
SCHEMBL11580551 0.79 NOTUM (0.40) ALDH1A1TDP1HSD17B10L3MBTL1ALOX15
SCHEMBL30255502 0.79 KDM4E (0.53) ALDH1A1TDP1HSD17B10TSHRPTGS2
SCHEMBL6853273 0.79 KDM4E (0.53) ALDH1A1TDP1HSD17B10TSHRPTGS2

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
WO-2025059655-A1 COPOLYMERS AND PROCESSES FOR RECYCLABLE POLYMER MATERIAL USING ENAMINE-COVALENT ADAPTABLE NETWORKS FLO MATERIALS, INC. (US) 2025-03-20 WO disclosed
WO-2025059659-A1 MATERIALS AND PROCESSES FOR MATERIAL FORMS USING ENAMINE-COVALENT ADAPTABLE NETWORKS FLO MATERIALS, INC. (US) 2025-03-20 WO disclosed
US-20100121022-A1 1,3-DIPOLAR CYCLOADDITION OF AZIDES TO ALKYNES HENKEL AG & CO. KGAA (DE) 2010-05-13 US disclosed