SCHEMBL2603265

SCHEMBL2603265

CC(C)C1=CCN(C(=O)CO)CC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
CCNT1 O60563 7/20 0.36
CDK9 P50750 7/20 0.36
FKBP1A P62942 1/20 0.35
CNR1 P21554 1/20 0.35
MAPK1 P28482 1/20 0.34
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
ALDH1A1 P00352 2/20 0.33
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
NAMPT P43490 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32
AKR1C3 P42330 1/20 0.32

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
SCHEMBL12030754 0.86 NAMPT (0.45) MEN1KMT2AFKBP1AALDH1A1NAMPT
SCHEMBL25633280 0.85 MEN1 (0.36) MEN1KMT2AFKBP1ACNR1MAPK1
SCHEMBL12026425 0.83 NAMPT (0.47) MEN1KMT2AFKBP1AALDH1A1BCHE
SCHEMBL17306136 0.83 MEN1 (0.33) MEN1KMT2AFKBP1AALDH1A1BCHE
SCHEMBL8178812 0.83 KDM4E (0.45) MEN1KMT2ACCNT1CDK9CNR1
SCHEMBL25743035 0.81 MEN1 (0.41) MEN1KMT2ACCNT1CDK9CNR1
SCHEMBL104852 0.81 QDPR (0.45) KMT2AKCNH2HRH3NAMPT
SCHEMBL12030751 0.79 NAMPT (0.43) KCNH2HRH3NAMPTNPC1RAB9A
SCHEMBL19998528 0.79 JAK1 (0.48) MEN1KMT2ANPC1
SCHEMBL17660297 0.78 MAPT (0.39) MEN1KMT2ACCNT1CDK9KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362008-B2 Amido-thiophene compounds and their use as 11-beta-HSD1 inhibitors THE UNIVERSITY OF EDINBURGH (GB) 2013-01-29 US disclosed
US-20120095046-A1 Amido-Isothiazole Compounds and Their Use as Inhibitors of 11Beta-HSD1 for the Treatment of Metabolic Syndrome and Related Disorders THE UNIVERSITY OF EDINBURGH (GB) 2012-04-19 US disclosed
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors THE UNIVERSITY OF EDINBURGH 2010-10-21 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 (2 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-20120095046-A1 Amido-Isothiazole Compounds and Their Use as Inhibitors of 11Beta-HSD1 for the Treatment of Metabolic Syndrome and Related Disorders HSD11B1, HSD11B2, HSD3B1 MEN1 2558/4885KMT2A 2032/4885CCNT1 3024/4885
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors HSD11B1, HSD11B2, HSD17B1 MEN1 3334/4885KMT2A 2185/4885CCNT1 1993/4885

“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.