SCHEMBL528969

SCHEMBL528969

Cc1ccc(N(Cc2ccc(NC(=O)c3ccc(C#N)cc3)cc2)S(=O)(=O)c2ccccc2)cc1C

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.60
ALDH1A1 P00352 2/20 0.57
KDM4E B2RXH2 1/20 0.57
LMNA P02545 5/20 0.55
SMN1; SMN2 Q16637 3/20 0.53
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
POLB P06746 2/20 0.52
SIRT2 Q8IXJ6 1/20 0.51
PTGES O14684 1/20 0.49

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
SCHEMBL527969 0.91 MAPT (0.60) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL529003 0.91 MAPT (0.66) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL527884 0.90 MAPT (0.74) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL531055 0.88 MAPT (0.71) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL528227 0.88 ALDH1A1 (0.64) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL528483 0.88 MAPT (0.54) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL529561 0.87 SMN1; SMN2 (0.48) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL528901 0.86 MAPT (0.74) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL529151 0.85 MAPT (0.52) MAPTALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL528374 0.85 SMN1; SMN2 (0.45) MAPTALDH1A1KDM4ELMNASMN1; SMN2

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
WO-2012014127-A1 5-LIPOXYGENASE INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2012-02-02 WO disclosed