SCHEMBL2995366

SCHEMBL2995366

COc1cc(Cl)c(CC2CCN([C@@H]3CCCC[C@@H]3C)C2=O)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
HSD11B1 P28845 1/20 0.36
ALDH1A1 P00352 2/20 0.34
PPOX P50336 1/20 0.34
TSHR P16473 1/20 0.34
NPBWR1 P48145 1/20 0.34
HTR1A P08908 1/20 0.34
SLC6A4 P31645 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
PIK3CA P42336 1/20 0.33
PRKDC P78527 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL2995365 1.00 HTR2A (0.37) HTR2AHTR2CHTR2BHSD11B1ALDH1A1
SCHEMBL2995369 1.00 HTR2A (0.37) HTR2AHTR2CHTR2BHSD11B1ALDH1A1
SCHEMBL208406 0.87 HSD11B1 (0.51) HTR2AHTR2CHTR2BHSD11B1ALDH1A1
SCHEMBL2992024 0.85 HSD11B1 (0.38) HSD11B1ALDH1A1KDM4EKMT2A
SCHEMBL2992025 0.85 HSD11B1 (0.38) HSD11B1ALDH1A1KDM4EKMT2A
SCHEMBL2992027 0.85 HSD11B1 (0.38) HSD11B1ALDH1A1KDM4EKMT2A
SCHEMBL2997558 0.84 DRD2 (0.36) HSD11B1
SCHEMBL2997561 0.84 DRD2 (0.36) HSD11B1
SCHEMBL2997556 0.84 DRD2 (0.36) HSD11B1
SCHEMBL474782 0.81 HSD11B1 (0.39) HTR2AHTR2CHTR2BHSD11B1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100184764-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2010-07-22 US disclosed
US-7713979-B2 Cycloalkyl lactam derivatives as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2010-05-11 US disclosed
EP-1807072-B1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2009-01-07 EP disclosed
US-20080275043-A1 Cycloalkyl Lactam Derivatives as Inhibitors of 11-Beta-Hydroxysteroid Dehydrogenase 1 ELI LILLY AND COMPANY 2008-11-06 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-20080275043-A1 Cycloalkyl Lactam Derivatives as Inhibitors of 11-Beta-Hydroxysteroid Dehydrogenase 1 HSD11B1, HSDL2, HSD17B1 HTR2A 1571/4885HTR2C 2050/4885HTR2B 1738/4885
US-20100184764-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 HTR2A 1310/4885HTR2C 1526/4885HTR2B 1231/4885

“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.