SCHEMBL208299

SCHEMBL208299

COC1CCC(N2CCC(Cc3c(Cl)cc(-c4ccc(C(=O)N5CCC(C(F)(F)F)CC5)cc4)cc3Cl)C2=O)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 3/20 0.40
PARP2 Q9UGN5 3/20 0.40
ALK Q9UM73 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
HTR2B P41595 2/20 0.35
HRH3 Q9Y5N1 4/20 0.35
MET P08581 1/20 0.35
P2RX7 Q99572 1/20 0.35
NAMPT P43490 1/20 0.35
LMNA P02545 1/20 0.35
MAPK7 Q13164 1/20 0.34
TSHR P16473 1/20 0.34
HPGD P15428 1/20 0.34
SPR P35270 1/20 0.34
MGLL Q99685 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
SCHEMBL208297 1.00 PARP1 (0.40) PARP1PARP2ALKMRGPRX4HTR2B
SCHEMBL208298 1.00 PARP1 (0.40) PARP1PARP2ALKMRGPRX4HTR2B
SCHEMBL209043 0.91 P2RX7 (0.39) HTR2BHRH3P2RX7NAMPTTSHR
SCHEMBL209041 0.91 P2RX7 (0.39) HTR2BHRH3P2RX7NAMPTTSHR
SCHEMBL209042 0.91 P2RX7 (0.39) HTR2BHRH3P2RX7NAMPTTSHR
SCHEMBL381542 0.90 NAMPT (0.36) HTR2BHRH3METP2RX7NAMPT
SCHEMBL381543 0.90 NAMPT (0.36) HTR2BHRH3METP2RX7NAMPT
SCHEMBL13107044 0.90 MET (0.33) PARP1PARP2ALKHTR2BHRH3
SCHEMBL208929 0.90 HTR2B (0.37) HTR2BHRH3METNAMPTSPR
SCHEMBL208557 0.90 HTR2B (0.37) HTR2BHRH3METNAMPTSPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088776-B2 Biphenyl amide lactam derivatives as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2012-01-03 US claimed
US-20090156571-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-06-18 US claimed
EP-2016047-B1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11- BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2013-08-28 EP disclosed
US-8088776-B2 Biphenyl amide lactam derivatives as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2012-01-03 US disclosed
US-20090156571-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-06-18 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 (1 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-20090156571-A1 BIPHENYL AMIDE LACTAM DERIVATIVES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD11B2 PARP1 1052/4885PARP2 3176/4885ALK 3227/4885

“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.