SCHEMBL5662926

SCHEMBL5662926

CC(=O)c1ccccc1-c1nc(C(=O)N2CCCC[C@H]2c2ccccn2)cs1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 10/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
TRPC3 Q13507 1/20 0.44
TRPC6 Q9Y210 1/20 0.44
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
SCD5 Q86SK9 1/20 0.41
GPBAR1 Q8TDU6 1/20 0.41
CPT2 P23786 4/20 0.40
CPT1B Q92523 3/20 0.40
MAPT P10636 2/20 0.40
GAA P10253 1/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
HTR2C P28335 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL5661450 1.00 CPT1A (0.46) CPT1ANPC1RAB9ATRPC3TRPC6
SCHEMBL4982379 0.85 CPT1A (0.54) CPT1ANPC1RAB9ATRPC3TRPC6
SCHEMBL3544402 0.85 CPT1A (0.54) CPT1ANPC1RAB9ATRPC3TRPC6
SCHEMBL4987440 0.84 HTR2C (0.59) CPT1ANPC1RAB9ATRPC3TRPC6
SCHEMBL4977346 0.84 HTR2C (0.59) CPT1ANPC1RAB9ATRPC3TRPC6
SCHEMBL4970654 0.83 TRPC3 (0.53) NPC1RAB9ATRPC3TRPC6GAA
SCHEMBL5661432 0.81 RAB9A (0.45) NPC1RAB9ATRPC3TRPC6MAPT
SCHEMBL3536540 0.80 CNR1 (0.45) NPC1RAB9ATRPC3TRPC6CNR1
SCHEMBL5660603 0.79 TP53 (0.44) NPC1RAB9ATRPC3TRPC6CNR1
SCHEMBL4980637 0.78 MAP4K1 (0.48) CPT1ANPC1RAB9ATRPC3TRPC6

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-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
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
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 CPT1A 95/4885NPC1 891/4885RAB9A 3912/4885

“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.