SCHEMBL4969597

SCHEMBL4969597

CCC1CCCCN1C(=O)c1csc(-c2cccc(Cl)c2Cl)n1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.64
RAB9A P51151 2/20 0.51
LMNA P02545 2/20 0.51
NPC1 O15118 1/20 0.51
HPGD P15428 1/20 0.51
TSHR P16473 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
PANK3 Q9H999 1/20 0.47
TP53 P04637 1/20 0.47
TLR7 Q9NYK1 1/20 0.45
MAPT P10636 1/20 0.43
GRM5 P41594 4/20 0.42
ALDH1A1 P00352 1/20 0.42
NR2F2 P24468 1/20 0.42
TRPC3 Q13507 1/20 0.41
TRPC6 Q9Y210 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HSD11B1 P28845 1/20 0.41

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
SCHEMBL4974424 0.92 HTR2C (0.61) HTR2CRAB9ALMNANPC1HPGD
SCHEMBL4973954 0.88 HTR2C (0.69) HTR2CRAB9ALMNANPC1HPGD
SCHEMBL4973419 0.84 HTR2C (0.67) HTR2CRAB9ALMNANPC1HPGD
SCHEMBL5661432 0.83 RAB9A (0.45) HTR2CRAB9ALMNANPC1HPGD
SCHEMBL3536845 0.82 HTR2C (0.64) HTR2CPANK3TLR7TRPC3TRPC6
SCHEMBL3538109 0.82 ACKR3 (0.55) RAB9ALMNANPC1HPGDTSHR
SCHEMBL4971120 0.81 HTR2C (0.62) HTR2CPANK3TLR7TRPC3TRPC6
SCHEMBL4973873 0.80 RAB9A (0.43) HTR2CRAB9ALMNANPC1HPGD
SCHEMBL27751143 0.80 RAB9A (0.43) HTR2CRAB9ALMNANPC1HPGD
SCHEMBL4972336 0.80 HTR2C (0.57) HTR2CRAB9ALMNANPC1HPGD

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
EP-1979335-A2 THIAZOLES AS 11 BETA-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2008-10-15 EP claimed
WO-2007082808-A2 THIAZOLES AS 11 BETA-HSD1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-07-26 WO claimed
US-7645773-B2 Thiazoles as inhibitors of 11β-hydroxysteroid dehydrogenase HOFFMANN-LA ROCHE INC. (US) 2010-01-12 US disclosed
US-7645773-B2 Thiazoles as inhibitors of 11β-hydroxysteroid dehydrogenase HOFFMANN-LA ROCHE INC. (US) 2010-01-12 US disclosed
EP-1979335-A2 THIAZOLES AS 11 BETA-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2008-10-15 EP disclosed
WO-2007082808-A2 THIAZOLES AS 11 BETA-HSD1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-07-26 WO disclosed
WO-2007082808-A2 THIAZOLES AS 11 BETA-HSD1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-07-26 WO disclosed
US-20070167622-A1 [2-(3-chloro-phenyl)-thiazol-4-yl]-(octahydro-quinolin-1-yl)-methanone; azocan-1-yl-[2-(2,3-dichloro-phenyl)-thiazol-4-yl]-methanone; type II diabetes mellitus and metabolic syndrome GILLESPIE PAUL 2007-07-19 US disclosed
US-20070167622-A1 [2-(3-chloro-phenyl)-thiazol-4-yl]-(octahydro-quinolin-1-yl)-methanone; azocan-1-yl-[2-(2,3-dichloro-phenyl)-thiazol-4-yl]-methanone; type II diabetes mellitus and metabolic syndrome GILLESPIE PAUL 2007-07-19 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-20070167622-A1 [2-(3-chloro-phenyl)-thiazol-4-yl]-(octahydro-quinolin-1-yl)-methanone; azocan-1-yl-[2-(2,3-dichloro-phenyl)-thiazol-4-yl]-methanone; type II diabetes mellitus and metabolic syndrome GOT2, PC, CYP11B2 HTR2C 422/4885RAB9A 3912/4885LMNA 1948/4885

“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.