SCHEMBL7792887

SCHEMBL7792887

COc1cn(-c2ccccc2OC(F)F)nc(C(=O)N(C)C)c1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.38
PDE10A Q9Y233 1/20 0.37
P2RX7 Q99572 7/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
NR1I2 O75469 1/20 0.33

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
SCHEMBL519829 0.92 KCNN4 (0.37) KCNN4PDE10AP2RX7KMT2ANPC1
SCHEMBL518986 0.88 KCNN4 (0.40) KCNN4PDE10AP2RX7KMT2ANPC1
SCHEMBL518611 0.87 NR1I2 (0.41) KCNN4PDE10AP2RX7KMT2ANPC1
SCHEMBL10291029 0.85 KMT2A (0.41) KCNN4PDE10AP2RX7KMT2ANPC1
SCHEMBL518491 0.85 MAPT (0.37) KCNN4PDE10AP2RX7KMT2ANPC1
SCHEMBL518490 0.85 MAPT (0.37) KCNN4PDE10AP2RX7KMT2ANPC1
SCHEMBL7789764 0.84 PDE10A (0.51) PDE10AKMT2ANPC1RAB9AMEN1
SCHEMBL18780770 0.81 HCRTR1 (0.35) KCNN4P2RX7HCRTR1HCRTR2NR1I2
SCHEMBL7793846 0.78 PDE10A (0.37) PDE10AKMT2ANPC1RAB9AMEN1
SCHEMBL17227404 0.77 ALDH1A1 (0.38) PDE10AP2RX7KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8916566-B2 Pyridazinone compounds as phosphodiesterase inhibitors and methods of treating disorders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-12-23 US disclosed
US-8916566-B2 Pyridazinone compounds as phosphodiesterase inhibitors and methods of treating disorders TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-12-23 US disclosed
US-20100197651-A1 Pyridazinone compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-05 US disclosed
US-20100197651-A1 Pyridazinone compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-05 US 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-20100197651-A1 Pyridazinone compounds PDE3A, PDE5A, PDE3B KCNN4 850/4885PDE10A 9/4885P2RX7 890/4885

“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.