SCHEMBL8284080

SCHEMBL8284080

CCN(Cc1ccccc1)C[C@H](O)C(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
PGR P06401 1/20 0.47
ADRA2A P08913 1/20 0.47
ADRA2B P18089 1/20 0.47
HTR2A P28223 1/20 0.47
HRH1 P35367 1/20 0.47
KCNH2 Q12809 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
BCHE P06276 4/20 0.45
LMNA P02545 1/20 0.45
NPC1 O15118 1/20 0.44
ACHE P22303 3/20 0.44
MDM2 Q00987 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
PTPN1 P18031 1/20 0.43
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
Benzoic Acid SCHEMBL4162737 0.77 MEP1B (0.55) L3MBTL1BCHELMNAACHEHDAC8
SCHEMBL11240083 0.76 HPGD (0.47) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL7088913 0.76 POLB (0.66) POLBL3MBTL1BCHELMNANPC1
SCHEMBL11306681 0.75 NPC1 (0.64) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL16934693 0.75 PTPN1 (0.45) POLBL3MBTL1LMNANPC1CYP1A2
SCHEMBL29038862 0.75 PTPN1 (0.45) POLBL3MBTL1LMNANPC1CYP1A2
SCHEMBL11674390 0.75 PGR (0.50) PGRADRA2AADRA2BHTR2AHRH1
Maleic Acid SCHEMBL15468081 0.75 POLB (0.50) POLBL3MBTL1BCHELMNANPC1
Maleic Acid SCHEMBL15468080 0.75 POLB (0.50) POLBL3MBTL1BCHELMNANPC1
Fumaric Acid SCHEMBL15468084 0.75 POLB (0.50) POLBL3MBTL1BCHELMNANPC1

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-7354920-B2 Aryl and heteroaryl morpholine derivatives ELI LILLY AND COMPANY (US) 2008-04-08 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
WO-2005060949-A2 SELECTIVE NOREPINEPHRINE REUPTAKE INHIBITORS FOR THE TREATMENT OF HOT FLASHES, IMPULSE CONTROL DISORDERS AND PERSONALITY CHANGE DUE TO A GENERAL MEDICAL CONDITION ELI LILLY AND COMPANY (US) 2005-07-07 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 (3 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-20070105960-A1 Treatment of learning disabilities and motor skills disorder with norepinephrine reuptake inhibitors SLC6A2, SLC6A3, SLC6A4 POLB 2895/4885PGR 3584/4885ADRA2A 54/4885
US-20070032554-A1 Treatment of stuttering and other communication disorders with norepinephrine reuptake inhibitors SLC6A2, SLC6A4, SLC6A3 POLB 3035/4885PGR 3602/4885ADRA2A 51/4885
US-20070015786-A1 Treatment of hot flashes, impulse control disorders and personality change due to a general medical condition SLC6A2, SLC6A4, HTR5A POLB 4682/4885PGR 141/4885ADRA2A 25/4885

“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.