SCHEMBL12438154

SCHEMBL12438154

C=C1N(C)c2cc(BC)ccc2C1(C)C

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL4602685 0.79 TDP1 (0.45) MPITDP1
SCHEMBL2185507 0.76 TDP1 (0.43) MPITDP1
SCHEMBL4602213 0.76 TDP1 (0.43) MPITDP1
SCHEMBL5464264 0.76 MPI (0.56) MPITDP1
SCHEMBL4602650 0.73 TDP1 (0.41) MPITDP1
SCHEMBL8397425 0.71 HTT (0.51) MPITDP1
SCHEMBL918366 0.71 HTT (0.51) MPITDP1
SCHEMBL4603835 0.70 KMT2A (0.53) MPITDP1
SCHEMBL23590739 0.69 MPI (0.38) MPITDP1
SCHEMBL11503557 0.69 MPI (0.38) MPITDP1

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-2011096643-A1 PHOTOCHROMIC MATERIAL KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2011-08-11 WO disclosed