SCHEMBL3839485

SCHEMBL3839485

C=CCNC1C2CC3CC(C2)CC1C3

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
FDFT1 P37268 2/20 0.37
GGPS1 O95749 1/20 0.37
ABCG2 Q9UNQ0 1/20 0.37
EPHX2 P34913 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
ALDH1A1 P00352 2/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL630318 0.73 SMN1; SMN2 (0.42) SMN1; SMN2LMNAEPHX2TDP1ALDH1A1
Adamantane SCHEMBL2954042 0.72 KMT2A (0.37) ALDH1A1MEN1KMT2A
SCHEMBL1778693 0.72 SMN1; SMN2 (0.61) SMN1; SMN2LMNAFDFT1GGPS1ABCG2
SCHEMBL9974906 0.72 SMN1; SMN2 (0.45) SMN1; SMN2LMNAEPHX2TDP1ALDH1A1
SCHEMBL5385637 0.70 LMNA (0.48) SMN1; SMN2LMNAFDFT1GGPS1ABCG2
SCHEMBL11228127 0.69 SMN1; SMN2 (0.58) SMN1; SMN2LMNAEPHX2TDP1ALDH1A1
SCHEMBL150989 0.69 HSD11B1 (0.39)
SCHEMBL6686034 0.69 L3MBTL1 (0.45) SMN1; SMN2LMNAEPHX2TDP1ALDH1A1
SCHEMBL4067246 0.68 DPP4 (0.42) SMN1; SMN2EPHX2ALDH1A1
SCHEMBL6949868 0.67 SIGMAR1 (0.39) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9630921-B2 Tricyclic lactam derivatives as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA NV (BE) 2017-04-25 US disclosed
US-20160318865-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2016-11-03 US disclosed
US-9422284-B2 Tricyclic lactam derivatives as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2016-08-23 US disclosed
US-20160002229-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2016-01-07 US disclosed
US-9150512-B2 Tricyclic lactam derivatives as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2015-10-06 US disclosed
US-20140179732-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-06-26 US disclosed
US-8563591-B2 Tricyclic lactam derivatives as 11-beta hydroxysteroid dehydrogenase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2013-10-22 US disclosed
EP-1786774-B1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-10-14 EP disclosed
US-20080214597-A1 2-Adamantan-2-yl-2,3,3a,4,9,9a-hexahydro-benzo[f]isoindol-1-one; obesity, diabetes, obesity related cardiovascular diseases, dementia, cognition, osteoporosis, stress and glaucoma JANSSEN PHARMACEUTICAL N.V. (BE) 2008-09-04 US disclosed
EP-1786774-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-23 EP disclosed
WO-2006024628-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-03-09 WO disclosed
WO-2003064372-A1 2-ADAMANTYLALKYLAMINES AND THEIR USE IN THE TREATMENT OF CONDITIONS GENERALLY ASSOCIATED WITH ABNORMALITIES IN GLUTAMATERGIC TRANSMISSION VERNALIS RESEARCH LIMITED (GB) 2003-08-07 WO 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 (4 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-20160002229-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS HSD17B1, HSD17B11, HSD11B1 SMN1; SMN2 4409/4885LMNA 3306/4885FDFT1 34/4885
US-20080214597-A1 2-Adamantan-2-yl-2,3,3a,4,9,9a-hexahydro-benzo[f]isoindol-1-one; obesity, diabetes, obesity related cardiovascular diseases, dementia, cognition, osteoporosis, stress and glaucoma CHRM1, CHRNA7, CHRM5 SMN1; SMN2 3455/4885LMNA 1380/4885FDFT1 3277/4885
US-20160318865-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS HSD17B1, HSD17B11, HSD11B1 SMN1; SMN2 4409/4885LMNA 3306/4885FDFT1 34/4885
US-20140179732-A1 TRICYCLIC LACTAM DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS HSD17B1, HSD17B11, HSD11B1 SMN1; SMN2 4409/4885LMNA 3306/4885FDFT1 34/4885

“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.