SCHEMBL11132960

SCHEMBL11132960

Nc1ccc(-c2ccc(C(=O)Oc3ccccc3)cc2)cc1N

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.54
▸ TDP1 Q9NUW8 3/20 0.54
▸ PARP10 Q53GL7 1/20 0.53
▸ TMPRSS15 P98073 2/20 0.51
▸ PRSS1 P07477 1/20 0.51
▸ ACR P10323 1/20 0.51
▸ NSD2 O96028 1/20 0.49
▸ ALOX5 P09917 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.47
▸ HDAC1 Q13547 1/20 0.46
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ IKBKB O14920 1/20 0.45
▸ LMNA P02545 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ CHRM1 P11229 1/20 0.44
▸ TBXA2R P21731 1/20 0.44

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
Water SCHEMBL27930155 0.98 MAPT (0.52) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL27205424 0.89 MAPT (0.59) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL1901502 0.87 MAPT (0.55) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL68278 0.85 PARP10 (0.63) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL13019485 0.85 PARP10 (0.63) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL812882 0.83 PARP10 (0.55) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL2462824 0.83 PARP10 (0.61) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL3136588 0.82 PARP10 (0.62) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL26375073 0.81 PARP10 (0.65) MAPTTDP1PARP10TMPRSS15PRSS1
SCHEMBL1901504 0.80 KMT2A (0.64) MAPTTDP1PARP10ALDH1A1MEN1

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
EP-0115944-A2 Production of high molecular weight polybenzimidazoles CELANESE CORPORATION (US) 1984-08-15 — — EP disclosed
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