SCHEMBL5032609

SCHEMBL5032609

COCC1CCCN1C(=O)c1csc(N(C(=O)c2ccc(Cl)cc2Cl)c2ccc(OC)c(OC)c2)n1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
HCRTR1 O43613 9/20 0.40
HCRTR2 O43614 9/20 0.40
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
DRD2 P14416 1/20 0.36
KMT2A Q03164 1/20 0.36
HSD11B1 P28845 1/20 0.36
CNR2 P34972 1/20 0.35
SCD O00767 1/20 0.35

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
SCHEMBL5032615 1.00 DPP4 (0.43) DPP4DPP8DPP9HCRTR1HCRTR2
SCHEMBL5034694 0.92 DPP4 (0.47) DPP4DPP8DPP9NPC1RAB9A
SCHEMBL5034695 0.92 DPP4 (0.47) DPP4DPP8DPP9NPC1RAB9A
SCHEMBL5035140 0.89 HSD11B1 (0.41) HCRTR1HCRTR2NPC1RAB9AHSD11B1
SCHEMBL5034701 0.85 HSD11B1 (0.41) HCRTR1HCRTR2NPC1RAB9AHSD11B1
SCHEMBL5032521 0.85 DPP4 (0.42) DPP4DPP8DPP9NPC1RAB9A
SCHEMBL5032519 0.85 DPP4 (0.42) DPP4DPP8DPP9NPC1RAB9A
SCHEMBL5035125 0.84 KMT2A (0.43) NPC1RAB9AKMT2A
SCHEMBL5032473 0.84 RAB9A (0.42) NPC1RAB9AKMT2A
SCHEMBL5032648 0.84 ALDH1A1 (0.48) NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371751-B2 Thiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US claimed
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP claimed
US-20050153962-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 US claimed
US-7371751-B2 Thiazole derivatives HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US disclosed
EP-1694673-B1 THIAZOLE DERIVATES HOFFMANN LA ROCHE (CH) 2008-01-16 EP disclosed
US-20050153962-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2005-07-14 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-20050153962-A1 Thiazole derivatives CNR1, CNR2, GPR119 DPP4 973/4885DPP8 1931/4885DPP9 1428/4885

“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.