SCHEMBL1810288

SCHEMBL1810288

O=C(S)Cc1ccc2c(c1)C(=O)CC2

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.51
AKR1B1 P15121 2/20 0.43
IL4I1 Q96RQ9 1/20 0.43
BRD4 O60885 2/20 0.40
HRH3 Q9Y5N1 2/20 0.38
MAOA P21397 3/20 0.37
MAOB P27338 3/20 0.37
BAZ1A Q9NRL2 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
HSD17B10 Q99714 1/20 0.36
HSD17B1 P14061 1/20 0.36

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
SCHEMBL1807895 0.87 AKR1B1 (0.50) PBRM1AKR1B1MAOAMAOBCASP1
SCHEMBL1347195 0.85 AKR1B1 (0.58) PBRM1AKR1B1IL4I1BRD4HSD17B10
SCHEMBL1810289 0.80 PBRM1 (0.51) PBRM1AKR1B1IL4I1BRD4HRH3
SCHEMBL23589273 0.80 ALDH1A1 (0.48) PBRM1AKR1B1IL4I1BRD4MAOA
SCHEMBL31660699 0.79 PBRM1 (0.58) PBRM1AKR1B1IL4I1BRD4HRH3
SCHEMBL4818350 0.79 PBRM1 (0.58) PBRM1AKR1B1IL4I1BRD4HRH3
SCHEMBL7605245 0.79 PBRM1 (0.53) PBRM1AKR1B1IL4I1BRD4HRH3
SCHEMBL4812956 0.76 PBRM1 (0.55) PBRM1AKR1B1IL4I1BRD4HRH3
SCHEMBL1346675 0.75 AKR1B1 (0.52) PBRM1AKR1B1MAOAMAOBHSD17B10
SCHEMBL1477730 0.75 PBRM1 (0.50) PBRM1AKR1B1IL4I1BRD4

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 PBRM1 1933/4885AKR1B1 2382/4885IL4I1 744/4885

“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.