SCHEMBL381545

SCHEMBL381545

CNC(=O)N1CCC(N2CCC(Cc3c(Cl)cc(-c4ccc(C(=O)N5CCC(C(F)(F)F)CC5)cc4)cc3Cl)C2=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.38
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MET P08581 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
SPR P35270 3/20 0.34
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
HTR2B P41595 1/20 0.34
CXCR3 P49682 1/20 0.34
P2RX7 Q99572 2/20 0.33
PTPN1 P18031 1/20 0.33
CCR3 P51677 1/20 0.33
HSD11B1 P28845 1/20 0.33
LMNA P02545 1/20 0.33
RORC P51449 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
SCHEMBL381544 1.00 NAMPT (0.38) NAMPTALDH1A1SMN1; SMN2METHRH3
SCHEMBL381543 0.90 NAMPT (0.36) NAMPTMETHRH3SPRACACB
SCHEMBL381542 0.90 NAMPT (0.36) NAMPTMETHRH3SPRACACB
SCHEMBL381006 0.90 NAMPT (0.34) NAMPTALDH1A1SMN1; SMN2METHRH3
SCHEMBL13031218 0.89 MET (0.36) NAMPTSMN1; SMN2METSPRHTR2B
SCHEMBL208372 0.89 HSD11B1 (0.41) NAMPTALDH1A1METSPRHTR2B
SCHEMBL3127709 0.88 HRH3 (0.37) NAMPTMETHRH3SPRHTR2B
SCHEMBL3125447 0.88 HRH3 (0.37) NAMPTMETHRH3SPRHTR2B
SCHEMBL208929 0.88 HTR2B (0.37) NAMPTMETHRH3SPRHTR2B
SCHEMBL208557 0.88 HTR2B (0.37) NAMPTMETHRH3SPRHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049513-B1 PIPERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2012-01-25 EP claimed
US-7829582-B2 Piperidinyl substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2010-11-09 US claimed
US-20090088430-A1 PIERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-04-02 US claimed
EP-2049513-B1 PIPERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2012-01-25 EP disclosed
US-7829582-B2 Piperidinyl substituted pyrrolidinones as inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2010-11-09 US disclosed
EP-2049513-A1 PIERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 Eli Lilly & Company (US) 2009-04-22 EP disclosed
US-20090088430-A1 PIERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY 2009-04-02 US disclosed
WO-2007127901-A1 PIERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 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 (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-20090088430-A1 PIERIDINYL SUBSTITUTED PYRROLIDINONES AS INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD17B1, HSD3B1 NAMPT 1894/4885ALDH1A1 141/4885SMN1; SMN2 4042/4885

“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.