SCHEMBL5713541

SCHEMBL5713541

Cc1cc(C)cc(NC(=O)N(S)C(=O)c2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.51
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
POLB P06746 2/20 0.40
KCNK3 O14649 1/20 0.40
KCNK9 Q9NPC2 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40

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
SCHEMBL14859165 0.84 ALDH1A1 (0.51) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL14860314 0.83 NPC1 (0.50) TDP1MEN1KMT2ANPC1RAB9A
SCHEMBL220071 0.82 SMN1; SMN2 (0.37) TDP1MEN1KMT2ANPC1RAB9A
SCHEMBL220680 0.82 MEN1 (0.41) TDP1MEN1KMT2ARAB9AMAPT
SCHEMBL5713553 0.81 NPC1 (0.62) MEN1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL222250 0.79 MEN1 (0.36) TDP1MEN1KMT2ANPC1RAB9A
SCHEMBL5713570 0.78 NPSR1 (0.54) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL5713503 0.78 RAB9A (0.54) TDP1MEN1KMT2ANPC1RAB9A
SCHEMBL2862569 0.76 RAB9A (0.59) MEN1KMT2ANPC1RAB9AMAPT
SCHEMBL220188 0.76 MEN1 (0.37) TDP1MEN1KMT2ARAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1583752-B1 CYCLIZATION PROCESS FOR SUBSTITUTED BENZOTHIAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2006-08-16 EP disclosed
US-7087761-B2 Cyclization process for substituted benzothiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2006-08-08 US disclosed
EP-1583752-A2 CYCLIZATION PROCESS FOR SUBSTITUTED BENZOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2005-10-12 EP disclosed
WO-2004060879-A2 CYCLIZATION PROCESS FOR SUBSTITUTED BENZOTHIAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2004-07-22 WO disclosed
US-20040138465-A1 Cyclization process for substituted benzothiazole derivatives HOFFMANN-LA ROCHE INC. 2004-07-15 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 (1 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-20040138465-A1 Cyclization process for substituted benzothiazole derivatives CBR3, CBR1, OXTR THRB 873/4885TDP1 4722/4885MEN1 4578/4885

“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.