SCHEMBL32682192

SCHEMBL32682192

O=[N+]([O-])c1ccc(Cl)cc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.58
MAPK1 P28482 2/20 0.58
CYP3A4 P08684 4/20 0.50
ALDH1A1 P00352 3/20 0.50
ALOX15 P16050 2/20 0.50
SIRT6 Q8N6T7 1/20 0.50
HPGD P15428 1/20 0.50
HIF1A Q16665 1/20 0.50
TXNRD1 Q16881 1/20 0.50
TXNRD3 Q86VQ6 1/20 0.50
TXNRD2 Q9NNW7 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
AR P10275 6/20 0.49
LMNA P02545 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
PGR P06401 2/20 0.49
CES2 O00748 1/20 0.49

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
SCHEMBL3610741 1.00 TSHR (0.58) TSHRMAPK1CYP3A4ALDH1A1ALOX15
SCHEMBL11429558 0.87 PDE7A (0.52) TSHRMAPK1CYP3A4ALDH1A1ALOX15
SCHEMBL2653845 0.85 CCR2 (0.55) TSHRMAPK1CYP3A4ALDH1A1ALOX15
SCHEMBL5181510 0.83 MAPK1 (0.60) TSHRMAPK1CYP3A4ALDH1A1TDP1
SCHEMBL11410600 0.82 AR (0.54) TSHRMAPK1CYP3A4ALDH1A1ALOX15
SCHEMBL12445316 0.81 MAPK1 (0.58) TSHRMAPK1ALDH1A1TDP1LMNA
SCHEMBL17347346 0.81 RAB9A (0.47) TSHRMAPK1CYP3A4ALDH1A1ALOX15
SCHEMBL27426321 0.81 TSHR (0.46) TSHRMAPK1CYP3A4ALDH1A1ALOX15
SCHEMBL11159312 0.80 TDP1 (0.59) TSHRMAPK1TDP1ARMEN1
SCHEMBL2639009 0.79 SIRT6 (0.51) TSHRMAPK1CYP3A4ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4707391-A1 NUCLEIC ACID COMPOUNDS FOR ZPI INHIBITION e-therapeutics PLC (GB) 2026-03-11 EP disclosed