SCHEMBL13986178

SCHEMBL13986178

CC(C)(C)C1=CC(=C/N=N/c2ccc(C(C)(C)c3ccc(/N=N/C=C4C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C4)cc3)cc2)C=C(C(C)(C)C)C1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GPR35 Q9HC97 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CES2 O00748 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ CES1 P23141 1/20 0.31
▸ MPI P34949 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ PTPN11 Q06124 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
SCHEMBL15893568 0.89 MAPT (0.37) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL13580310 0.88 ATM (0.38) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL14280269 0.87 NPC1 (0.37) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL13749169 0.87 ATM (0.37) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL15893570 0.85 NPC1 (0.36) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL15893569 0.85 CYP2D6 (0.36) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL141575 0.85 ATM (0.36) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL13580484 0.85 ATM (0.36) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL21179846 0.85 SMN1; SMN2 (0.40) ATMNPC1KMT2AGPR35SMN1; SMN2
SCHEMBL13986184 0.85 SMN1; SMN2 (0.40) ATMNPC1KMT2AGPR35SMN1; SMN2

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-7468230-B2 Wet-developing electrophotographic photoconductor and wet-developing image KYOCERA MITA CORPORATION (JP) 2008-12-23 — — US disclosed
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