SCHEMBL10569871

SCHEMBL10569871

CCCCN1CCc2nc3cc(Cl)ccc3c(NNc3ccccc3)c2C1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.48
BCHE P06276 5/20 0.41
GRM5 P41594 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
SLC2A1 P11166 1/20 0.40

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
SCHEMBL10572027 0.96 ACHE (0.50) ACHEBCHEMEN1KMT2ATDP1
SCHEMBL10573809 0.90 ACHE (0.46) ACHEBCHEMEN1KMT2ATDP1
SCHEMBL10573396 0.85 ACHE (0.55) ACHEBCHE
SCHEMBL10572159 0.84 ACHE (0.49) ACHEBCHEMEN1KMT2A
SCHEMBL10572348 0.82 ACHE (0.47) ACHEBCHEMEN1KMT2A
SCHEMBL10572075 0.78 ACHE (0.51) ACHEBCHEMEN1KMT2A
SCHEMBL10572246 0.76 ACHE (0.68) ACHEBCHEKMT2A
SCHEMBL10481927 0.74 ACHE (0.47) ACHEBCHE
SCHEMBL10612178 0.74 ACHE (0.47) ACHEBCHE
SCHEMBL7380712 0.74 ACHE (0.56) ACHEBCHE

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
US-4816464-A ANTIINFLAMMATORY AGENTS, ENZYME TISSUE DESTRUCTION AMERICAN HOME PRODUCTS CORPORATION (US) 1989-03-28 US claimed
US-4816464-A ANTIINFLAMMATORY AGENTS, ENZYME TISSUE DESTRUCTION AMERICAN HOME PRODUCTS CORPORATION (US) 1989-03-28 US disclosed