SCHEMBL14447522

SCHEMBL14447522

CC(C)c1ccc2c(c1)CCC1C(C)(CNC(=S)C(C)(C)C)CCC[C@]21C

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 11/20 0.78
▸ KARS1 Q15046 1/20 0.68
▸ MEN1 O00255 2/20 0.65
▸ CYP3A4 P08684 2/20 0.65
▸ KMT2A Q03164 2/20 0.65
▸ TSHR P16473 2/20 0.65
▸ PDK1 Q15118 1/20 0.65
▸ PDK2 Q15119 1/20 0.65
▸ PDK3 Q15120 1/20 0.65
▸ PDK4 Q16654 1/20 0.65
▸ CYP2D6 P10635 1/20 0.65
▸ CYP2C9 P11712 1/20 0.65
▸ CYP2C19 P33261 1/20 0.65
▸ TP53 P04637 1/20 0.64
▸ MAPT P10636 1/20 0.64
▸ ALOX15 P16050 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ HDAC3 O15379 1/20 0.61
▸ HDAC1 Q13547 1/20 0.61
▸ HDAC2 Q92769 1/20 0.61

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
SCHEMBL9112314 0.87 TDP1 (0.82) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL20856806 0.87 TDP1 (0.82) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL11817724 0.85 TDP1 (0.82) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL9107959 0.85 TDP1 (0.78) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL289598 0.85 MEN1 (0.77) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL9109761 0.84 TDP1 (0.76) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL20874417 0.84 TDP1 (0.76) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL18431217 0.84 TDP1 (0.76) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL14496633 0.84 TDP1 (0.76) TDP1KARS1MEN1CYP3A4KMT2A
SCHEMBL29975241 0.83 TDP1 (0.79) TDP1KARS1MEN1CYP3A4KMT2A

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-7244847-B2 Benzimidazole compounds ISIS PHARMACEUTICALS, INC. (US) 2007-07-17 — — US disclosed
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