SCHEMBL7784469

SCHEMBL7784469

COc1cn(-c2ccc(OCc3ccccc3)cc2F)nc(C(=O)N(C)C)c1=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
GYS1 P13807 2/20 0.39
FFAR1 O14842 4/20 0.38
PPARD Q03181 4/20 0.38
TDP1 Q9NUW8 1/20 0.38
PDE10A Q9Y233 2/20 0.38
PARP14 Q460N5 1/20 0.38
PARP10 Q53GL7 1/20 0.38
ALKBH1 Q13686 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
MEN1 O00255 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
SCHEMBL518433 0.93 APP (0.39) KMT2AGYS1FFAR1PPARDTDP1
SCHEMBL518822 0.90 MAOB (0.42) KMT2AFFAR1PPARDPDE10APARP14
SCHEMBL519275 0.89 KMT2A (0.43) KMT2AFFAR1PPARDPDE10APARP14
SCHEMBL8369696 0.84 PDE10A (0.42) PDE10AALKBH1
SCHEMBL10259026 0.83 MRGPRX4 (0.40) KMT2AFFAR1PPARDALKBH1L3MBTL1
SCHEMBL7784391 0.80 MAP2K1 (0.41) KMT2APDE10AMEN1
SCHEMBL10258331 0.79 MRGPRX4 (0.43) KMT2AFFAR1PPARDALKBH1MRGPRX4
SCHEMBL10258841 0.78 MRGPRX4 (0.44) KMT2AFFAR1PPARDALKBH1MRGPRX4
SCHEMBL15004755 0.78 APP (0.39) KMT2APDE10AMEN1
SCHEMBL18793189 0.76 CYP1A2 (0.37) KMT2APDE10AL3MBTL1MEN1

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 KMT2A 1726/4885GYS1 3864/4885FFAR1 2699/4885

“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.