SCHEMBL1809696

SCHEMBL1809696

O=C(CSc1ccc(CO)nn1)NCC1CN(Cc2ccc(Cl)c(Cl)c2)CCO1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 2/20 0.53
ALDH1A1 P00352 3/20 0.49
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
DRD4 P21917 3/20 0.43
HPGD P15428 3/20 0.43
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CYP2C9 P11712 1/20 0.41
ADRA2B P18089 1/20 0.41
HTR2C P28335 1/20 0.41
SLC6A4 P31645 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
SCHEMBL1809698 1.00 CCR3 (0.53) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1808829 0.91 CCR3 (0.55) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1808831 0.91 CCR3 (0.55) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1810595 0.91 CCR3 (0.55) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1810599 0.91 CCR3 (0.55) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1808802 0.90 CCR3 (0.49) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1808805 0.90 CCR3 (0.49) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1811852 0.89 CCR3 (0.53) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1808930 0.89 CCR3 (0.56) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL1808936 0.89 CCR3 (0.56) CCR3ALDH1A1RAB9ANPC1SMN1; SMN2

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
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-7935700-B2 Morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-03 US 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 (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-20070265257-A1 Morpholine Compound CCR3, CCR1, CCR4 CCR3 1/4885ALDH1A1 2661/4885RAB9A 2642/4885

“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.