SCHEMBL3466712

SCHEMBL3466712

O=C(Nc1ccc(Cl)c(Cl)c1)Nc1nnc(Cc2ccc(F)cc2)s1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 13/20 0.67
▸ KMT2A Q03164 13/20 0.67
▸ MAPT P10636 6/20 0.65
▸ HTT P42858 5/20 0.65
▸ LMNA P02545 5/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.65
▸ RAB9A P51151 3/20 0.65
▸ BLM P54132 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ POLB P06746 1/20 0.57
▸ GAA P10253 1/20 0.57
▸ DNMT1 P26358 1/20 0.57
▸ DUSP3 P51452 1/20 0.57
▸ CACNA1B Q00975 1/20 0.57
▸ APBA1 Q02410 1/20 0.57
▸ MCL1 Q07820 1/20 0.57
▸ WRN Q14191 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ ABL1 P00519 1/20 0.57

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
SCHEMBL3467090 0.91 MEN1 (0.68) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3467467 0.88 MEN1 (0.62) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3467256 0.83 MEN1 (0.74) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3477465 0.82 KMT2A (0.76) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3467894 0.82 MEN1 (0.62) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3467776 0.81 MEN1 (0.56) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3466713 0.80 MEN1 (0.62) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3468497 0.79 SMN1; SMN2 (0.70) MEN1KMT2AMAPTHTTLMNA
SCHEMBL5445001 0.78 BLM (0.61) MEN1KMT2AMAPTHTTLMNA
SCHEMBL3467221 0.78 MAPT (0.77) MEN1KMT2AMAPTHTTLMNA

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
WO-2010073011-A2 COMPOUNDS USEFUL AS MEDICAMENTS BETAGENON AB (SE) 2010-07-01 — — WO claimed
WO-2010073011-A2 COMPOUNDS USEFUL AS MEDICAMENTS BETAGENON AB (SE) 2010-07-01 — — WO disclosed
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