SCHEMBL529348

SCHEMBL529348

Cc1ccc(N(Cc2cccc(NC(=O)c3cc(Cl)ccc3Cl)c2)S(C)(=O)=O)cc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.51
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
MAPT P10636 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
LMNA P02545 6/20 0.46
POLB P06746 3/20 0.44
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
CSF1R P07333 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
ACKR3 P25106 1/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL528321 0.92 MEN1 (0.48) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL528589 0.90 MEN1 (0.52) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL528022 0.89 LMNA (0.49) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL529458 0.89 MAPT (0.52) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL528554 0.87 MEN1 (0.57) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL528847 0.85 MEN1 (0.55) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL529102 0.84 MAPT (0.55) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL529590 0.83 LMNA (0.49) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL528484 0.83 MEN1 (0.48) SMN1; SMN2MEN1KMT2AMAPTNPSR1
SCHEMBL528522 0.83 MEN1 (0.52) SMN1; SMN2MEN1KMT2AMAPTNPSR1

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