SCHEMBL2990029

SCHEMBL2990029

Cn1c(-c2ccccc2Cl)nnc1C(C)(C)c1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 13/20 0.56
PDE2A O00408 2/20 0.43
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 2/20 0.40
HPGD P15428 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
SCHEMBL2991823 0.84 HSD11B1 (0.49) HSD11B1ALDH1A1SMN1; SMN2KDM4E
SCHEMBL2995306 0.83 HSD11B1 (0.55) HSD11B1PDE2AALDH1A1SMN1; SMN2NPC1
SCHEMBL18905854 0.80 HSD11B1 (0.71) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL7988162 0.80 HSD11B1 (0.54) HSD11B1PDE2AALDH1A1SMN1; SMN2NPC1
SCHEMBL2992855 0.79 HTR7 (0.37) HSD11B1ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL7980912 0.77 HSD11B1 (0.67) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL2983487 0.77 HSD11B1 (0.67) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL2985553 0.75 HSD11B1 (0.55) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL2747473 0.74 HSD11B1 (1.00) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA
SCHEMBL2983476 0.74 HSD11B1 (0.61) HSD11B1ALDH1A1SMN1; SMN2NPC1LMNA

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-7776897-B2 such as 3-[1-(5-chloro-2-thienyl)cyclopenty]-5,6,7,8,9,10-hexahydro [1,2,4]triazolo[4,3-a]azocine, having a strong 11 beta -hydroxysteroid dehydrogenase type 1inhibitory activity and exhibiting an excellent blood-glucose level-lowering action, used for the therapy of diabetes and insulin resistance ASTELLAS PHARMA INC. (JP) 2010-08-17 US claimed
US-20070259854-A1 Triazole Derivative or Salt Thereof ASTELLAS PHARMA INC. (JP) 2007-11-08 US claimed
EP-1790641-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2007-05-30 EP claimed
US-7776897-B2 such as 3-[1-(5-chloro-2-thienyl)cyclopenty]-5,6,7,8,9,10-hexahydro [1,2,4]triazolo[4,3-a]azocine, having a strong 11 beta -hydroxysteroid dehydrogenase type 1inhibitory activity and exhibiting an excellent blood-glucose level-lowering action, used for the therapy of diabetes and insulin resistance ASTELLAS PHARMA INC. (JP) 2010-08-17 US disclosed
US-20070259854-A1 Triazole Derivative or Salt Thereof ASTELLAS PHARMA INC. (JP) 2007-11-08 US disclosed
EP-1790641-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2007-05-30 EP 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-20070259854-A1 Triazole Derivative or Salt Thereof HSD11B1, HSD11B2, HSD3B1 HSD11B1 1/4885PDE2A 934/4885ALDH1A1 288/4885

“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.