SCHEMBL3536965

SCHEMBL3536965

CN(C(=O)c1csc(-c2ccccc2Cl)n1)C1CCCCC1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.58
TSHR P16473 2/20 0.56
HPGD P15428 1/20 0.56
ALDH1A1 P00352 3/20 0.54
LMNA P02545 1/20 0.54
HTT P42858 1/20 0.54
HSD11B1 P28845 1/20 0.50
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
HTR2C P28335 3/20 0.48
S1PR1 P21453 1/20 0.43
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TLR7 Q9NYK1 1/20 0.41
MAPT P10636 1/20 0.41
FFAR2 O15552 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
SCHEMBL3535406 0.85 HTR2C (0.46) CNR1TSHRHPGDALDH1A1LMNA
SCHEMBL3538125 0.84 NPC1 (0.47) CNR1TSHRHPGDALDH1A1LMNA
SCHEMBL12753574 0.80 CNR1 (0.59) CNR1TSHRHPGDALDH1A1LMNA
SCHEMBL3537086 0.77 HTR2C (0.54) TSHRLMNAHTTHSD11B1RAB9A
SCHEMBL10989088 0.76 TSPO (0.60) CNR1TSHRHPGDALDH1A1LMNA
SCHEMBL4972824 0.76 NPC1 (0.64) CNR1NPC1RAB9AHTR2CTLR7
SCHEMBL4969464 0.75 HTR2C (0.58) TSHRHPGDALDH1A1HTTHSD11B1
SCHEMBL4972130 0.75 HTR2C (0.58) TSHRHPGDALDH1A1HTTHSD11B1
SCHEMBL25188325 0.75 NPC1 (0.47) CNR1TSHRHPGDALDH1A1HSD11B1
SCHEMBL3536962 0.74 CHRM1 (0.53) CNR1ALDH1A1NPC1RAB9AHTR2C

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
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

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 CNR1 888/4885TSHR 1802/4885HPGD 1113/4885

“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.