SCHEMBL31031275

SCHEMBL31031275

[N-]=[N+]=NCCOCCOCCOCCOCCOCCn1ccnc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
POLB P06746 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MGMT P16455 1/20 0.44
MAPK1 P28482 2/20 0.43
CYP51A1 Q16850 1/20 0.42
TBXAS1 P24557 4/20 0.42
KDM4E B2RXH2 2/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
QPCT Q16769 1/20 0.39
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NOS1 P29475 1/20 0.38

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
SCHEMBL26307842 0.98 ALDH1A1 (0.47) ALDH1A1POLBKMT2AMEN1CYP1A2
SCHEMBL13007775 0.83 ALDH1A1 (0.63) ALDH1A1POLBKMT2AMEN1CYP1A2
SCHEMBL13007784 0.83 ALDH1A1 (0.63) ALDH1A1POLBKMT2AMEN1CYP1A2
SCHEMBL26103563 0.81 TBXAS1 (0.52) CYP51A1TBXAS1QPCT
SCHEMBL4425773 0.81 TBXAS1 (0.60) ALDH1A1POLBKMT2AMEN1CYP1A2
SCHEMBL26307611 0.76 MGMT (0.43) MGMT
SCHEMBL4783651 0.75 ALDH1A1 (0.59) ALDH1A1POLBKMT2AMEN1CYP1A2
SCHEMBL502382 0.75 ALDH1A1 (0.59) ALDH1A1POLBKMT2AMEN1CYP1A2
SCHEMBL18469637 0.75 ALDH1A1 (0.55) ALDH1A1POLBKMT2AMEN1CYP1A2
SCHEMBL5148219 0.75 ALDH1A1 (0.68) ALDH1A1POLBKMT2AMEN1CYP1A2

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-4652160-A1 COMPOUNDS FOR NUCLEIC ACID CLEAVAGE Cambridge Enterprise Limited (GB) 2025-11-26 EP disclosed
WO-2024153950-A1 COMPOUNDS FOR NUCLEIC ACID CLEAVAGE CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-07-25 WO disclosed