SCHEMBL11864305

SCHEMBL11864305

CSc1ccc(Oc2ccc([N+](=O)[O-])c(N)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.56
▸ ALDH1A1 P00352 4/20 0.56
▸ LMNA P02545 2/20 0.56
▸ TSHR P16473 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ HTT P42858 1/20 0.40
▸ PDE7A Q13946 2/20 0.40
▸ SIRT6 Q8N6T7 1/20 0.40
▸ TRPV1 Q8NER1 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ NR4A1 P22736 1/20 0.38
▸ SLC6A4 P31645 1/20 0.37
▸ RECQL P46063 1/20 0.37
▸ TTR P02766 1/20 0.37
▸ ALB P02768 1/20 0.37
▸ THRB P10828 1/20 0.37

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
SCHEMBL9195043 0.86 MAPT (0.67) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL11012447 0.83 MAPT (0.60) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL5955457 0.83 ALDH1A1 (0.60) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL5348283 0.83 TDP1 (0.65) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL914291 0.82 TDP1 (0.58) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL30060469 0.81 MAPT (0.58) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL7807114 0.81 MAPT (0.58) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL1373865 0.80 HSPB1 (0.57) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL11655847 0.80 MAPT (0.56) MAPTALDH1A1LMNATSHRTDP1
SCHEMBL11015121 0.80 MAPT (0.56) MAPTALDH1A1LMNATSHRTDP1

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-3965113-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-06-22 — — US disclosed
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