SCHEMBL13097056

SCHEMBL13097056

Oc1cccc(N2CCC3(CCCO3)CC2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.44
SLC6A2 P23975 3/20 0.44
SLC6A4 P31645 3/20 0.44
SLC6A3 Q01959 3/20 0.44
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
DRD3 P35462 1/20 0.43
HTR7 P34969 2/20 0.41
OPRM1 P35372 3/20 0.40
FFAR4 Q5NUL3 1/20 0.40
RORC P51449 1/20 0.39
KIF11 P52732 2/20 0.37
USP2 O75604 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 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
SCHEMBL12160679 0.80 LGMN (0.49) DRD2SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL13097055 0.77 SLC6A2 (0.51) SLC6A2SLC6A4SLC6A3FFAR4SMN1; SMN2
SCHEMBL1599836 0.75 MEN1 (0.60) DRD2MEN1KMT2ADRD3OPRM1
SCHEMBL17144785 0.75 MEN1 (0.60) DRD2MEN1KMT2ADRD3OPRM1
SCHEMBL29774627 0.75 MEN1 (0.60) DRD2MEN1KMT2ADRD3OPRM1
SCHEMBL29914690 0.75 MEN1 (0.60) DRD2MEN1KMT2ADRD3OPRM1
SCHEMBL9723025 0.75 DRD2 (0.68) DRD2MEN1KMT2ADRD3HTR7
SCHEMBL16400691 0.74 MEN1 (0.51) DRD2MEN1KMT2ADRD3HTR7
SCHEMBL13106640 0.74 GRIN1 (0.47) DRD2SLC6A2SLC6A4SLC6A3MEN1
SCHEMBL32211602 0.74 KMO (0.60) DRD2MEN1KMT2ADRD3KIF11

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-8367702-B2 Quinolone derivative ASTELLAS PHARMA INC. (JP) 2013-02-05 US disclosed
US-8367702-B2 Quinolone derivative ASTELLAS PHARMA INC. (JP) 2013-02-05 US disclosed
US-20100256113-A1 QUINOLONE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed
US-20100256113-A1 QUINOLONE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed
EP-2194044-A1 QUINOLONE DERIVATIVE Astellas Pharma Inc. (JP) 2010-06-09 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-20100256113-A1 QUINOLONE DERIVATIVE NQO1, NQO2, NADK DRD2 3106/4885SLC6A2 1834/4885SLC6A4 2561/4885

“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.