SCHEMBL2994796

SCHEMBL2994796

CC1(N2CCCC2=O)CCC2(CC1)OCCO2

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 2/20 0.35
BRD4 O60885 1/20 0.34
BRD2 P25440 1/20 0.34
KDM4E B2RXH2 1/20 0.33
CYP2C19 P33261 1/20 0.32
GAA P10253 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 1/20 0.30
USP2 O75604 1/20 0.30
HPGD P15428 1/20 0.30
ATM Q13315 1/20 0.30
MAPK1 P28482 1/20 0.30

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
SCHEMBL25157210 0.80 BRD4 (0.43) ALDH1A1TSHRBRD4BRD2MAPK1
SCHEMBL2999035 0.78 BRD4 (0.41) ALDH1A1KMT2ABRD4BRD2
SCHEMBL7583601 0.74 POLB (0.41) ALDH1A1TSHRKMT2AKDM4EGAA
SCHEMBL25157105 0.74 ALDH1A1 (0.41) ALDH1A1TSHRBRD4BRD2CYP2C19
SCHEMBL24749998 0.72 AR (0.39) ALDH1A1BRD4BRD2
SCHEMBL22857097 0.71 PIK3CD (0.37) ALDH1A1BRD4BRD2
SCHEMBL25157379 0.69 BRD4 (0.40) ALDH1A1TSHRKMT2ABRD4BRD2
SCHEMBL6160038 0.69 ALDH1A1 (0.34) ALDH1A1BRD4BRD2
SCHEMBL6160033 0.69 ALDH1A1 (0.34) ALDH1A1BRD4BRD2
SCHEMBL25157655 0.68 BRD4 (0.39) ALDH1A1BRD4BRD2

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 ALDH1A1 108/4885TSHR 4029/4885KMT2A 2240/4885
US-20100184764-A1 CYCLOALKYL LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 ALDH1A1 118/4885TSHR 4108/4885KMT2A 2654/4885

“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.