SCHEMBL9840924

SCHEMBL9840924

C=C1N(C)c2ccncc2C1(C)C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 1/20 0.35
ADORA3 P0DMS8 1/20 0.33
ADORA2A P29274 1/20 0.33
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL10039932 0.75 ADORA3 (0.33) ADORA3ADORA2A
SCHEMBL8397425 0.73 HTT (0.51) MPITDP1LMNAGAAMAPT
SCHEMBL918366 0.73 HTT (0.51) MPITDP1LMNAGAAMAPT
SCHEMBL4603835 0.69 KMT2A (0.53) MPITDP1LMNAGAAMAPT
SCHEMBL25890244 0.69 MEN1 (0.44) LMNAADORA3ADORA2AGAAMAPT
SCHEMBL25891479 0.68 GAA (0.38) LMNAADORA3ADORA2AGAAMAPT
SCHEMBL5975249 0.68 MPI (0.43) MPITDP1LMNAMAPTHTT
SCHEMBL3809912 0.68 POLB (0.43) MPITDP1LMNAMAPTHTT
SCHEMBL4602881 0.68 MPI (0.43) MPITDP1MAPTHTTKMT2A
SCHEMBL4604095 0.68 MPI (0.43) MPITDP1LMNAGAAMAPT

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
US-4986934-A SPIROBENZOXAZINE PYRROLOPYRIDINE COMPOUNDS, EYEGLASSES PPG INDUSTRIES, INC. (US) 1991-01-22 US disclosed