SCHEMBL8395487

SCHEMBL8395487

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 6/20 0.36
ALDH1A1 P00352 4/20 0.36
LMNA P02545 2/20 0.36
USP2 O75604 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
HDAC1 Q13547 3/20 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
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
LTB4R2 Q9NPC1 1/20 0.34
ALOX15 P16050 2/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL8397851 0.92 SMN1; SMN2 (0.44) SMN1; SMN2MAPTALDH1A1MEN1KMT2A
SCHEMBL8395772 0.92 SMN1; SMN2 (0.41) SMN1; SMN2MAPTALDH1A1LMNAUSP2
SCHEMBL8398980 0.91 SMN1; SMN2 (0.41) SMN1; SMN2MAPTLMNAMEN1POLB
SCHEMBL8398989 0.90 SMN1; SMN2 (0.38) SMN1; SMN2MAPTALDH1A1LMNAGAA
SCHEMBL8399027 0.90 SMN1; SMN2 (0.40) SMN1; SMN2MAPTALDH1A1LMNAHPGD
SCHEMBL8399186 0.90 USP2 (0.40) MAPTALDH1A1LMNAUSP2HDAC1
SCHEMBL8399202 0.90 SMN1; SMN2 (0.52) SMN1; SMN2MAPTALDH1A1LMNAHPGD
SCHEMBL8396213 0.89 SMN1; SMN2 (0.39) SMN1; SMN2MAPTALDH1A1LMNAHPGD
SCHEMBL8396366 0.89 SMN1; SMN2 (0.39) SMN1; SMN2MAPTLMNAMEN1KMT2A
SCHEMBL8395482 0.88 SMN1; SMN2 (0.39) SMN1; SMN2MAPTALDH1A1MEN1KMT2A

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