SCHEMBL5218062

SCHEMBL5218062

C=CCC1(C)Cc2ccccc2N(Cc2ccc(OC)cc2)C1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CASP3 P42574 2/20 0.47
APAF1 O14727 1/20 0.47
GAA P10253 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
SCN9A Q15858 2/20 0.47
CMA1 P23946 1/20 0.45
OPRL1 P41146 1/20 0.43
GSK3B P49841 3/20 0.43
ALDH1A1 P00352 2/20 0.43
GSK3A P49840 2/20 0.43
BLM P54132 1/20 0.43
MAPT P10636 2/20 0.43
EP300 Q09472 1/20 0.42
LMNA P02545 1/20 0.41

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
SCHEMBL30100716 0.87 L3MBTL1 (0.52) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL23674985 0.87 L3MBTL1 (0.52) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL26086688 0.84 L3MBTL1 (0.54) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL16163267 0.81 L3MBTL1 (0.53) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL30100711 0.81 L3MBTL1 (0.53) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL16163258 0.79 L3MBTL1 (0.51) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL14938439 0.74 MEN1 (0.71) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL5988304 0.74 PTGDR2 (0.43) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL30100692 0.73 POLB (0.71) L3MBTL1MEN1KMT2ACASP3APAF1
SCHEMBL30100689 0.73 POLB (0.71) L3MBTL1MEN1KMT2ACASP3APAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1622874-B1 3,4-DIHYDRO-1H-QUINOLIN-2-ONE DERIVATIVES AS NOREPINEPHRINE REUPTAKE INHIBITORS LILLY CO ELI (US) 2007-10-03 EP disclosed
US-20070105845-A1 Quinolone derivatives ELI LILLY AND COMPANY PATENT DIVISION (US) 2007-05-10 US disclosed
US-20070105960-A1 Treatment of learning disabilities and motor skills disorder with norepinephrine reuptake inhibitors ELI LILLY AND COMPANY (US) 2007-05-10 US disclosed
US-20070032554-A1 Treatment of stuttering and other communication disorders with norepinephrine reuptake inhibitors ELILILLY AND COMPANY A CORPORATION 2007-02-08 US disclosed
US-20070015786-A1 Treatment of hot flashes, impulse control disorders and personality change due to a general medical condition ELI LILY AND COMPANY (US) 2007-01-18 US disclosed
US-20060241188-A1 Treatment of pervasive developemental disorders with norepinephrine reuptake inhibitors ELILILLY AND COMPANY (US) 2006-10-26 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 (5 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-20070105845-A1 Quinolone derivatives NQO2, NQO1, RECQL L3MBTL1 4674/4885MEN1 694/4885KMT2A 2950/4885
US-20060241188-A1 Treatment of pervasive developemental disorders with norepinephrine reuptake inhibitors SLC6A2, SLC6A3, SLC6A4 L3MBTL1 2442/4885MEN1 2755/4885KMT2A 647/4885
US-20070105960-A1 Treatment of learning disabilities and motor skills disorder with norepinephrine reuptake inhibitors SLC6A2, SLC6A3, SLC6A4 L3MBTL1 186/4885MEN1 4612/4885KMT2A 565/4885
US-20070032554-A1 Treatment of stuttering and other communication disorders with norepinephrine reuptake inhibitors SLC6A2, SLC6A4, SLC6A3 L3MBTL1 3451/4885MEN1 2243/4885KMT2A 2954/4885
US-20070015786-A1 Treatment of hot flashes, impulse control disorders and personality change due to a general medical condition SLC6A2, SLC6A4, HTR5A L3MBTL1 3499/4885MEN1 237/4885KMT2A 2399/4885

“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.