SCHEMBL31481111

SCHEMBL31481111

O=[N+]([O-])c1ccc(N2CC(F)C2)cc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.59
MAPT P10636 5/20 0.58
ALDH1A1 P00352 3/20 0.54
SIRT6 Q8N6T7 2/20 0.54
ADRB1 P08588 1/20 0.54
LMNA P02545 2/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
AKR1C3 P42330 1/20 0.45

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
SCHEMBL25191133 0.84 POLB (0.54) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL9983992 0.84 MAPT (0.61) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL25197695 0.84 POLB (0.67) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL6710563 0.81 MAPT (0.58) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL1750127 0.81 MAPT (0.58) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL6716676 0.81 MAPT (0.58) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL3549925 0.81 MAPT (0.58) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL12939934 0.81 MAPT (0.58) POLBMAPTALDH1A1SIRT6ADRB1
Hydrochloric Acid SCHEMBL6707092 0.80 MAPT (0.56) POLBMAPTALDH1A1SIRT6ADRB1
SCHEMBL16943124 0.80 MEN1 (0.60) POLBMAPTALDH1A1LMNAMEN1

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
WO-2025054339-A1 TRIAZOLOPYRIDINE COMPOUNDS AS INHIBITORS OF KIT ARCUS BIOSCIENCES, INC. (US) 2025-03-13 WO disclosed