SCHEMBL14075268

SCHEMBL14075268

CCCCCc1ccc(C(=O)Nc2cc(Cl)ccc2C(=O)O)cc1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 16/20 0.75
▸ PLK3 Q9H4B4 8/20 0.75
▸ KCNK2 O95069 2/20 0.68
▸ MEN1 O00255 1/20 0.61
▸ PKM P14618 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.61
▸ KDM4E B2RXH2 1/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ KCNK10 P57789 1/20 0.56

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
SCHEMBL14075264 0.96 PLK1 (0.69) PLK1PLK3KCNK2MEN1PKM
SCHEMBL14075262 0.87 SMN1; SMN2 (0.62) PLK1PLK3KCNK2MEN1PKM
SCHEMBL14075266 0.83 PLK1 (0.78) PLK1PLK3MEN1PKMKMT2A
SCHEMBL14075419 0.83 PLK1 (0.55) PLK1PLK3KCNK2MEN1PKM
SCHEMBL28808948 0.83 PLK1 (0.97) PLK1PLK3
SCHEMBL1308714 0.82 MEN1 (0.76) KCNK2MEN1PKMKMT2ANPSR1
SCHEMBL3366850 0.81 KCNK2 (1.00) PLK1PLK3KCNK2MEN1KMT2A
SCHEMBL29862876 0.81 KCNK2 (1.00) PLK1PLK3KCNK2MEN1KMT2A
SCHEMBL3366853 0.81 KCNK2 (1.00) PLK1PLK3KCNK2MEN1KMT2A
SCHEMBL10339426 0.80 SERPINE1 (0.69) PLK1PLK3

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-7429677-B2 Small molecule entry inhibitors TIBOTEC PHARMACEUTICALS LTD. (IE) 2008-09-30 — — US disclosed
US-7429677-B2 Small molecule entry inhibitors TIBOTEC PHARMACEUTICALS LTD. (IE) 2008-09-30 — — US disclosed
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