SCHEMBL25263306

SCHEMBL25263306

Cc1cn(C)nc1-c1cccc(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 5/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 4/20 0.45
CNR1 P21554 4/20 0.45
GPR55 Q9Y2T6 4/20 0.45
CNR2 P34972 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
HTT P42858 2/20 0.45
PKM P14618 1/20 0.45
PPARG P37231 1/20 0.45
NR2E3 Q9Y5X4 1/20 0.45
NCOR2 Q9Y618 1/20 0.45
GLA P06280 1/20 0.44
CYP3A4 P08684 1/20 0.44
KCNH2 Q12809 2/20 0.43

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
SCHEMBL30448189 1.00 NPSR1 (0.46) NPSR1ALDH1A1MEN1KMT2ALMNA
SCHEMBL14536979 0.80 MAP4K4 (0.45) ALDH1A1MEN1LMNANPC1RAB9A
SCHEMBL31277424 0.80 PSMD14 (0.46) NPSR1ALDH1A1MEN1KMT2ALMNA
SCHEMBL25221991 0.80 PSMD14 (0.46) NPSR1ALDH1A1MEN1KMT2ALMNA
SCHEMBL3754852 0.78 KMT2A (0.45) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL16381210 0.78 MAPK14 (0.49) NPSR1ALDH1A1KMT2ALMNANPC1
SCHEMBL11841693 0.76 ALDH1A1 (0.44) NPSR1ALDH1A1MEN1KMT2ALMNA
SCHEMBL25610918 0.75 JMJD6 (0.36) ALDH1A1LMNAMAPT
SCHEMBL25608550 0.74 LIPG (0.41) ALDH1A1MEN1KMT2ALMNAPKM
SCHEMBL13240021 0.73 L3MBTL1 (0.49) NPSR1ALDH1A1LMNAPPARGNPC1

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-4444309-A1 PYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2024-10-16 EP disclosed
WO-2023107603-A1 PYRIMIDINES AND METHODS OF THEIR USE Kineta, Inc. (US) 2023-06-15 WO disclosed