SCHEMBL8395662

SCHEMBL8395662

CCOC(=O)CCC(=O)N(Cc1nc2c(Cl)c(Cl)ccc2s1)c1ccc(OC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.39
TP53 P04637 5/20 0.37
LMNA P02545 2/20 0.37
THRB P10828 1/20 0.37
RNF4 P78317 1/20 0.35
MAPT P10636 5/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
GAA P10253 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
HDAC1 Q13547 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34

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
SCHEMBL8398032 0.92 SMN1; SMN2 (0.44) SMN1; SMN2TP53LMNATHRBMAPT
SCHEMBL8400414 0.92 SMN1; SMN2 (0.41) SMN1; SMN2TP53LMNAMAPTMEN1
SCHEMBL8399636 0.90 SMN1; SMN2 (0.38) SMN1; SMN2TP53LMNAMAPTGAA
SCHEMBL8396376 0.90 SMN1; SMN2 (0.40) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL8397981 0.90 SMN1; SMN2 (0.40) SMN1; SMN2LMNAMAPTALDH1A1HPGD
SCHEMBL8396242 0.90 SMN1; SMN2 (0.52) SMN1; SMN2TP53MAPTHPGDGAA
SCHEMBL8396279 0.90 USP2 (0.40) SMN1; SMN2TP53LMNATHRBRNF4
SCHEMBL8398046 0.89 SMN1; SMN2 (0.39) SMN1; SMN2TP53LMNAMAPTALDH1A1
SCHEMBL8400255 0.89 SMN1; SMN2 (0.39) SMN1; SMN2MAPTMEN1POLBKMT2A
SCHEMBL8396653 0.89 SMN1; SMN2 (0.39) SMN1; SMN2TP53LMNATHRBMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0647636-B1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF SENJU PHARMA CO (JP) 1999-06-09 EP disclosed
US-5532257-A ENZYME INHIBITOR SENJU PHARMACEUTICAL CO., LTD (JP) 1996-07-02 US disclosed
EP-0647636-A1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Senju Pharmaceutical Co., Ltd. (JP) 1995-04-12 EP disclosed