SCHEMBL5014179

SCHEMBL5014179

O=C1CN=C(c2ccccc2)N1C1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
NPSR1 Q6W5P4 1/20 0.44
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 1/20 0.43
MCOLN3 Q8TDD5 1/20 0.43
OPRL1 P41146 3/20 0.40
THRB P10828 1/20 0.40
CES2 O00748 1/20 0.40
OPRM1 P35372 2/20 0.40
OPRK1 P41145 2/20 0.40
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39

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
SCHEMBL14776447 0.71 NPSR1 (0.54) LMNANPSR1ALDH1A1KMT2AMCOLN3
SCHEMBL5012240 0.69 HSD11B1 (0.41) NPSR1GAAALDH1A1MEN1KMT2A
SCHEMBL9495400 0.67 NPSR1 (0.45) LMNANPSR1GAAALDH1A1KMT2A
SCHEMBL17083743 0.67 SLC18A3 (0.39) LMNAKDM4EGAAALDH1A1MEN1
SCHEMBL23967443 0.65 ALDH1A1 (0.65) LMNANPSR1KDM4EALDH1A1MEN1
SCHEMBL2653818 0.65 ALDH1A1 (0.65) LMNANPSR1KDM4EALDH1A1MEN1
SCHEMBL30987468 0.65 ALDH1A1 (0.65) LMNANPSR1KDM4EALDH1A1MEN1
SCHEMBL11088410 0.65 NPSR1 (0.50) NPSR1ALDH1A1MEN1KMT2AMCOLN3
Bicarbonate SCHEMBL14811674 0.64 ALDH1A1 (0.58) LMNANPSR1KDM4EGAAALDH1A1
SCHEMBL6763525 0.63 CES2 (0.46) NPSR1GAAALDH1A1MCOLN3CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249146-A1 Imidazole and Thioazole Derivatives as Antiviral Agents ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2008-10-09 US disclosed
EP-1773331-A1 IMIDAZOLE AND THIAZOLE DERIVATIVES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2007-04-18 EP disclosed
WO-2006008556-A1 IMIDAZOLE AND THIAZOLE DERIVATIVES AS ANTIVIRAL AGENTS ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2006-01-26 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-20080249146-A1 Imidazole and Thioazole Derivatives as Antiviral Agents IRF3, HAVCR2, ZC3HAV1 LMNA 4527/4885NPSR1 3815/4885KDM4E 2816/4885

“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.