SCHEMBL16578532

SCHEMBL16578532

CNC(=O)c1nn(CC2(c3cccc4ccccc34)CCCC2)cc(O)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 7/20 0.46
▸ SLC6A2 P23975 6/20 0.46
▸ SLC6A4 P31645 6/20 0.46
▸ PLK1 P53350 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ CBX7 O95931 1/20 0.33
▸ CDY1; CDY1B Q9Y6F8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CDYL Q9Y232 1/20 0.32
▸ OPRL1 P41146 1/20 0.32
▸ MTNR1A P48039 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ PTGS1 P23219 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL16578454 0.86 TNKS (0.33) SLC6A3SLC6A2SLC6A4MTNR1A
SCHEMBL16578460 0.85 HPGD (0.33) SLC6A3SLC6A2SLC6A4L3MBTL1
SCHEMBL20751218 0.85 KDM4E (0.41) L3MBTL1MTNR1AALDH1A1
SCHEMBL16578681 0.84 KDM4E (0.33) —
SCHEMBL16578629 0.84 HDAC1 (0.38) SLC6A3SLC6A2SLC6A4MAPTMTNR1A
SCHEMBL20751139 0.83 LMNA (0.41) SLC6A4MEN1KMT2ANPSR1L3MBTL1
SCHEMBL16578580 0.83 NR4A2 (0.36) MEN1KMT2AL3MBTL1ALDH1A1CNR1
SCHEMBL16578678 0.82 SLC6A3 (0.46) SLC6A3SLC6A2SLC6A4KMT2A
SCHEMBL16578590 0.82 PDE2A (0.34) MEN1MAPTKMT2AL3MBTL1ALDH1A1
SCHEMBL16578869 0.81 SLC6A2 (0.33) SLC6A3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10364226-B2 Pyridazinone compounds and uses thereof ALIOS BIOPHARMA, INC. (US) 2019-07-30 — — US disclosed
EP-3030549-B1 PYRIDAZINONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA INC (US) 2019-02-20 — — EP disclosed
WO-2015038660-A1 PYRIDAZINONE COMPOUNDS AND USES THEREOF ALIOS BIOPHARMA, INC. (US) 2015-03-19 — — 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-10364226-B2 Pyridazinone compounds and uses thereof PDXK, PNPO, PLPBP SLC6A3 4172/4885SLC6A2 4265/4885SLC6A4 3240/4885

“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.

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