SCHEMBL4802804

SCHEMBL4802804

CN(C(=O)C1CCCc2sc(NC(=O)CC3CCCCC3)nc21)C1CCN(Cc2c(Cl)cccc2Cl)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CSNK1D P48730 1/20 0.37
RORC P51449 3/20 0.37
DHODH Q02127 3/20 0.37
ACHE P22303 3/20 0.35
LCK P06239 1/20 0.35
NPY5R Q15761 1/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 2/20 0.34
JAK2 O60674 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 1/20 0.34
BCHE P06276 1/20 0.34
GRIN2B Q13224 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
SCHEMBL4796918 0.95 ACHE (0.42) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL4797365 0.86 NPY5R (0.37) ACHENPY5RALDH1A1MAPTJAK2
SCHEMBL4801194 0.85 RORC (0.35) KDM4ERAB9ANPC1SMN1; SMN2RORC
SCHEMBL3164354 0.84 ACHE (0.41) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL4797257 0.81 ACHE (0.41) KDM4ESMN1; SMN2RORCDHODHACHE
SCHEMBL4804674 0.80 ACHE (0.51) KDM4ESMN1; SMN2MEN1KMT2AACHE
SCHEMBL13452554 0.78 GLS (0.49) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL4805240 0.77 HDAC1 (0.42) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL4805873 0.77 CHRM4 (0.42) KDM4ERAB9ANPC1SMN1; SMN2MEN1
SCHEMBL13452555 0.76 CSNK1D (0.40) KDM4ERAB9ANPC1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7348347-B2 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2008-03-25 US claimed
US-20070027315-A1 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2007-02-01 US claimed
EP-1716128-B1 SUBSTITUTED 4,5,6,7-TETRAHYDRO-BENZOTHIAZOL-2-YLAMINE COMPOUNDS GRUENENTHAL GMBH (DE) 2010-03-31 EP disclosed
US-7348347-B2 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2008-03-25 US disclosed
US-7348347-B2 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2008-03-25 US disclosed
US-7348347-B2 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2008-03-25 US disclosed
US-20070027315-A1 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2007-02-01 US disclosed
US-20070027315-A1 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2007-02-01 US disclosed
US-20070027315-A1 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2007-02-01 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-20070027315-A1 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds TPH2, HTR6, TPH1 KDM4E 1046/4885RAB9A 3147/4885NPC1 2506/4885

“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.