SCHEMBL2993943

SCHEMBL2993943

C[C@H]1CC(N2CCC(Cc3ccc(Cl)cc3Cl)C2=O)CC[C@H]1O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 10/20 0.38
MAPT P10636 1/20 0.37
CCR3 P51677 1/20 0.36
HSD11B1 P28845 1/20 0.36
FFAR1 O14842 2/20 0.35
CTSD P07339 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
EPHX2 P34913 1/20 0.34

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
SCHEMBL2993945 1.00 P2RX7 (0.38) P2RX7MAPTCCR3HSD11B1FFAR1
SCHEMBL3004248 0.90 P2RX7 (0.38) P2RX7MAPTCCR3HSD11B1FFAR1
SCHEMBL2990534 0.90 P2RX7 (0.38) P2RX7MAPTCCR3HSD11B1FFAR1
SCHEMBL13955085 0.85 P2RX7 (0.37) P2RX7MAPTCCR3HSD11B1FFAR1
SCHEMBL2990514 0.84 P2RX7 (0.44) P2RX7CCR3HSD11B1FFAR1EPHX2
SCHEMBL2996038 0.84 P2RX7 (0.44) P2RX7CCR3HSD11B1FFAR1EPHX2
SCHEMBL2995839 0.84 P2RX7 (0.44) P2RX7CCR3HSD11B1FFAR1EPHX2
SCHEMBL2988948 0.82 SIGMAR1 (0.36) P2RX7MAPTCCR3FFAR1KDM4E
SCHEMBL2988951 0.82 SIGMAR1 (0.36) P2RX7MAPTCCR3FFAR1KDM4E
SCHEMBL2995370 0.82 SIGMAR1 (0.36) P2RX7MAPTCCR3FFAR1KDM4E

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 7 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 claimed
EP-1807072-B1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2009-01-07 EP claimed
US-20080275043-A1 Cycloalkyl Lactam Derivatives as Inhibitors of 11-Beta-Hydroxysteroid Dehydrogenase 1 ELI LILLY AND COMPANY 2008-11-06 US claimed
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 P2RX7 3884/4885MAPT 4656/4885CCR3 3722/4885
US-20100184764-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 P2RX7 4250/4885MAPT 4635/4885CCR3 1909/4885

“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.