SCHEMBL24724311

SCHEMBL24724311

CC(=O)c1ccc(-n2nnc(C)n2)nc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 6/20 0.52
HRH3 Q9Y5N1 2/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
UBE2T Q9NPD8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
RXRA P19793 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
KMT2A Q03164 1/20 0.33

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
SCHEMBL30003905 1.00 KCNJ1 (0.52) KCNJ1HRH3TSHRLMNAMAPT
SCHEMBL24775079 0.78 TSHR (0.49) KCNJ1TSHRMAPTKMT2A
SCHEMBL9108667 0.77 MAPT (0.39) KCNJ1MAPTSMN1; SMN2KMT2A
SCHEMBL15653751 0.76 KCNJ1 (0.55) KCNJ1HRH3TSHRLMNAMAPT
SCHEMBL30751818 0.74 KCNJ1 (0.48) KCNJ1KMT2A
SCHEMBL24668346 0.74 MAPT (0.64) KCNJ1HRH3LMNAMAPTUBE2T
SCHEMBL24724304 0.73 OGA (0.39) KCNJ1LMNASMN1; SMN2
SCHEMBL24724303 0.73 KCNJ1 (0.56) KCNJ1HRH3TSHRLMNAMAPT
SCHEMBL30004713 0.73 KCNJ1 (0.56) KCNJ1HRH3TSHRLMNAMAPT
SCHEMBL3595779 0.72 KCNJ1 (0.55) KCNJ1HRH3TSHRLMNAMAPT

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-2022253259-A1 FUSED HETEROCYCLIC DERIVATIVES Janssen Sciences Ireland Unlimited Company (IE) 2022-12-08 WO disclosed