SCHEMBL1809470

SCHEMBL1809470

CC(=O)Nc1nnc(SN(C[C@@H]2CN(Cc3ccc(F)c(F)c3)CCO2)C(C)=O)s1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 8/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
ALDH1A1 P00352 3/20 0.40
SIGMAR1 Q99720 3/20 0.39
RAB9A P51151 2/20 0.39
ENPP2 Q13822 1/20 0.38
APOBEC3A P31941 2/20 0.37
APOBEC3G Q9HC16 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAPT P10636 1/20 0.37
KDM4E B2RXH2 1/20 0.37
OGA O60502 1/20 0.37

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
SCHEMBL1807184 0.94 DRD4 (0.44) DRD4SMN1; SMN2CYP1A2CYP2C19HTT
SCHEMBL1813495 0.90 CCR3 (0.43) DRD4SMN1; SMN2CYP1A2CYP2C19HTT
SCHEMBL1808430 0.88 ALDH1A1 (0.44) DRD4HTTALDH1A1APOBEC3AAPOBEC3G
SCHEMBL1813907 0.88 DRD4 (0.44) DRD4CYP1A2CYP2C19ALDH1A1SIGMAR1
SCHEMBL1809472 0.82 ALDH1A1 (0.58) ALDH1A1RAB9AAPOBEC3AAPOBEC3GNPSR1
SCHEMBL1809477 0.82 ALDH1A1 (0.58) ALDH1A1RAB9AAPOBEC3AAPOBEC3GNPSR1
SCHEMBL1809983 0.82 DRD4 (0.45) DRD4CYP1A2CYP2C19SIGMAR1
SCHEMBL1809273 0.82 CCR3 (0.44) DRD4SMN1; SMN2CYP1A2CYP2C19HTT
SCHEMBL1807203 0.81 DRD4 (0.45) DRD4SIGMAR1RAB9AKDM4E
SCHEMBL1811262 0.81 CCR3 (0.41) DRD4SMN1; SMN2HTTALDH1A1MAPT

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 DRD4 768/4885SMN1; SMN2 932/4885CYP1A2 533/4885

“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.