SCHEMBL7937665

SCHEMBL7937665

C=CN=Nc1c(C)cccc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ HSP90AA1 P07900 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ CYP2A6 P11509 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ ACHE P22303 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ GRIN2D O15399 2/20 0.34
▸ GRIN3B O60391 2/20 0.34
▸ GRIN1 Q05586 2/20 0.34
▸ GRIN2A Q12879 2/20 0.34
▸ GRIN2B Q13224 2/20 0.34
▸ GRIN2C Q14957 2/20 0.34
▸ GRIN3A Q8TCU5 2/20 0.34

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
SCHEMBL10480070 0.79 ATM (0.68) ATMMEN1HSP90AA1KMT2ACYP2A6
SCHEMBL23242992 0.79 ATM (0.68) ATMMEN1HSP90AA1KMT2ACYP2A6
SCHEMBL15724815 0.74 CYP2C9 (0.44) MEN1KMT2ATSHRACHEALDH1A1
SCHEMBL11224625 0.72 ATM (0.54) ATMMEN1HSP90AA1KMT2ACYP2A6
SCHEMBL11224623 0.72 ATM (0.54) ATMMEN1HSP90AA1KMT2ACYP2A6
SCHEMBL6228963 0.70 MEN1 (0.43) ATMMEN1HSP90AA1KMT2AALDH1A1
SCHEMBL19336625 0.70 ATM (0.52) ATMMEN1HSP90AA1KMT2ACYP2A6
SCHEMBL25847142 0.70 ATM (0.38) ATMMEN1HSP90AA1KMT2ACYP2A6
SCHEMBL363817 0.69 ATM (0.44) ATMMEN1HSP90AA1KMT2ACYP2A6
SCHEMBL4350537 0.67 ATM (0.43) ATMMEN1HSP90AA1KMT2ACYP2A6

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-1163277-A1 METHOD FOR THE POLYMERIZATION AN COPOLYMERIZATION OF MONOLEFINS AND NOVEL PALLADIUM COMPLEXES THEREFOR BASF AKTIENGESELLSCHAFT (DE) 2001-12-19 — — EP disclosed
WO-2000050474-A1 METHOD FOR THE POLYMERIZATION AN COPOLYMERIZATION OF MONOLEFINS AND NOVEL PALLADIUM COMPLEXES THEREFOR BASF AKTIENGESELLSCHAFT (DE) 2000-08-31 — — WO disclosed
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