SCHEMBL428304

SCHEMBL428304

O=C1CCc2cc(OCCCN3CCCC3)ccc2N1

nearest known ligand 0.80

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 11/20 0.80
MAOB P27338 11/20 0.80
DRD2 P14416 3/20 0.70
HTR1A P08908 2/20 0.70
HTR2A P28223 2/20 0.70
HTR2C P28335 2/20 0.70
SLC6A4 P31645 2/20 0.70
HTR7 P34969 2/20 0.70
DRD3 P35462 2/20 0.70
DRD4 P21917 1/20 0.70
HRH3 Q9Y5N1 4/20 0.66

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
SCHEMBL10672507 0.90 DRD2 (0.67) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL10571057 0.87 DRD2 (0.75) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL23097595 0.86 DRD2 (0.81) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL10571545 0.86 MAOA (0.86) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL16559664 0.85 MAOA (1.00) MAOAMAOBDRD2
SCHEMBL23097720 0.84 DRD2 (0.75) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL10571461 0.84 DRD2 (0.66) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL23097641 0.84 DRD2 (0.66) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL10571129 0.84 DRD2 (0.68) MAOAMAOBDRD2HTR1AHTR2A
SCHEMBL11344730 0.84 KCNH2 (0.69) MAOAMAOBDRD2HTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8609847-B2 Dihydroquinolinone derivatives TAISHO PHARMACEUTICAL CO., LTD (JP) 2013-12-17 US disclosed
EP-2393802-B1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO LTD (JP) 2013-05-08 EP disclosed
EP-2393802-B1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO LTD (JP) 2013-05-08 EP disclosed
US-20120022064-A1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-26 US disclosed
US-20120022064-A1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-26 US disclosed
EP-2393802-A1 DIHYDROQUINOLINONE DERIVATIVES Taisho Pharmaceutical Co., Ltd. (JP) 2011-12-14 EP disclosed
WO-2010090347-A1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2010-08-12 WO disclosed
WO-2010090347-A1 DIHYDROQUINOLINONE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2010-08-12 WO 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-20120022064-A1 DIHYDROQUINOLINONE DERIVATIVES PER2, CRY1, BACE1 MAOA 230/4885MAOB 193/4885DRD2 10/4885

“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.