SCHEMBL5023503

SCHEMBL5023503

CCCCS(=O)(=O)Nc1ccc2nc(N(C(=O)c3ccccc3Cl)c3ccc(OC)c(OC)c3)sc2c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 4/20 0.38
MAPT P10636 5/20 0.38
PTGS2 P35354 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PKM P14618 1/20 0.36
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
LMNA P02545 3/20 0.36
RAB9A P51151 2/20 0.36
RAD52 P43351 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL5016991 0.92 PPARG (0.40) MAPTKDM4ENPSR1GSK3AGSK3B
SCHEMBL5016959 0.89 HDAC1 (0.40) GHSRMAPTPTGS2KDM4EHPGD
SCHEMBL5016928 0.88 HSD17B10 (0.42) GHSRMAPTPTGS2SMN1; SMN2KDM4E
SCHEMBL14365374 0.87 GHSR (0.41) GHSRMAPTPTGS2SMN1; SMN2KDM4E
SCHEMBL5023079 0.86 ALDH1A1 (0.44) MAPTSMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL5016958 0.84 MEN1 (0.44) GHSRMAPTPTGS2KDM4EHPGD
SCHEMBL5017118 0.82 NTRK1 (0.39) MAPTKDM4EHPGDNPSR1HSD17B10
SCHEMBL27677755 0.81 LMNA (0.53) MAPTSMN1; SMN2KDM4ELMNARAB9A
SCHEMBL5017068 0.81 PTGS2 (0.49) GHSRMAPTPTGS2SMN1; SMN2LMNA
SCHEMBL5022953 0.80 KDM4E (0.53) MAPTSMN1; SMN2KDM4EHPGDTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638556-B1 2-AMINOBENZOTHIAZOLES AS CB1 RECEPTOR INVERSE AGONISTS HOFFMANN LA ROCHE (CH) 2008-04-02 EP claimed
CN-100368407-C 2-aminobenzothiazoles as CB1 receptor inverse agonists HOFFMANN LA ROCHE (CH) 2008-02-13 CN claimed
US-7297707-B2 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. (US) 2007-11-20 US claimed
US-20070021478-A1 Benzothiazolyl derivatives NETTEKOVEN MATTHIAS H 2007-01-25 US claimed
US-20040266845-A1 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. 2004-12-30 US claimed
EP-1638556-B1 2-AMINOBENZOTHIAZOLES AS CB1 RECEPTOR INVERSE AGONISTS HOFFMANN LA ROCHE (CH) 2008-04-02 EP disclosed
CN-100368407-C 2-aminobenzothiazoles as CB1 receptor inverse agonists HOFFMANN LA ROCHE (CH) 2008-02-13 CN disclosed
US-7297707-B2 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. (US) 2007-11-20 US disclosed
US-7297707-B2 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. (US) 2007-11-20 US disclosed
US-7297707-B2 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. (US) 2007-11-20 US disclosed
US-20070021478-A1 Benzothiazolyl derivatives NETTEKOVEN MATTHIAS H 2007-01-25 US disclosed
US-20070021478-A1 Benzothiazolyl derivatives NETTEKOVEN MATTHIAS H 2007-01-25 US disclosed
US-20070021478-A1 Benzothiazolyl derivatives NETTEKOVEN MATTHIAS H 2007-01-25 US disclosed
US-20040266845-A1 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. 2004-12-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070021478-A1 Benzothiazolyl derivatives CNR1, CNR2, GPR119 GHSR 143/4885MAPT 3262/4885PTGS2 2165/4885
US-20040266845-A1 Benzothiazolyl derivatives CNR1, CNR2, GPR119 GHSR 171/4885MAPT 3619/4885PTGS2 1724/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.