SCHEMBL1809972

SCHEMBL1809972

CCOC(=O)Cc1csc(SCC(=O)NCC2CN(Cc3ccc(Cl)c(Cl)c3)CCO2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
CCR3 P51677 3/20 0.46
ALDH1A1 P00352 4/20 0.46
NPSR1 Q6W5P4 1/20 0.44
ALOX15 P16050 2/20 0.44
POLB P06746 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CYP2C9 P11712 1/20 0.42
ADRA2B P18089 1/20 0.42
HTR2C P28335 1/20 0.42
SLC6A4 P31645 1/20 0.42
CYP2C19 P33261 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
SCHEMBL1809974 1.00 HPGD (0.47) HPGDCCR3ALDH1A1NPSR1ALOX15
SCHEMBL1811191 0.96 HPGD (0.48) HPGDCCR3ALDH1A1NPSR1ALOX15
SCHEMBL1811189 0.96 HPGD (0.48) HPGDCCR3ALDH1A1NPSR1ALOX15
SCHEMBL1807385 0.94 HPGD (0.45) HPGDCCR3ALDH1A1NPSR1ALOX15
SCHEMBL1807387 0.94 HPGD (0.45) HPGDCCR3ALDH1A1NPSR1ALOX15
SCHEMBL1813489 0.94 HPGD (0.46) HPGDCCR3ALDH1A1NPSR1ALOX15
SCHEMBL1813488 0.94 HPGD (0.46) HPGDCCR3ALDH1A1NPSR1ALOX15
SCHEMBL1807606 0.94 HPGD (0.49) HPGDALDH1A1NPSR1ALOX15POLB
SCHEMBL1807608 0.94 HPGD (0.49) HPGDALDH1A1NPSR1ALOX15POLB
SCHEMBL1806553 0.93 HPGD (0.47) HPGDALDH1A1NPSR1ALOX15MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2042499-B1 SALT OF A MORPHOLINE COMPOUND MITSUBISHI TANABE PHARMA CORP (JP) 2018-06-27 EP disclosed
EP-1801108-B9 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2013-11-20 EP disclosed
EP-1801108-B1 MORPHOLINE COMPOUNDS FOR THE TREATMENT OF INFLAMMATIONS MITSUBISHI TANABE PHARMA CORP (JP) 2012-11-14 EP disclosed
US-8030303-B2 Salt of morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-10-04 US disclosed
US-7935700-B2 Morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-03 US disclosed
US-20090264430-A1 Salt of morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-22 US disclosed
EP-2042499-A1 SALT OF MORPHOLINE COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2009-04-01 EP disclosed
US-20070265257-A1 Morpholine Compound MITSUBISHI PHARMA CORPORATION (JP) 2007-11-15 US disclosed
EP-1801108-A1 MORPHOLINE COMPOUND Mitsubishi Pharma Corporation (JP) 2007-06-27 EP 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 (2 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-20090264430-A1 Salt of morpholine compound SLC11A2, SLC16A7, AVPR2 HPGD 2722/4885CCR3 4068/4885ALDH1A1 996/4885
US-20070265257-A1 Morpholine Compound CCR3, CCR1, CCR4 HPGD 3730/4885CCR3 1/4885ALDH1A1 2661/4885

“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.