SCHEMBL1710318

SCHEMBL1710318

O=C(O)N1CCN(S(=O)(=O)c2c[nH]c(=O)c3ccc(Br)cc23)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
RXFP1 Q9HBX9 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GPR183 P32249 3/20 0.36
LMNA P02545 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
EPHX2 P34913 1/20 0.36
POLB P06746 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
SCHEMBL1710700 0.96 KMT2A (0.40) PKMKMT2AMEN1RXFP1LMNA
SCHEMBL2391300 0.85 TGM2 (0.45) PKMKMT2AMEN1MAPTEPHX2
SCHEMBL2394793 0.81 TGM2 (0.44) KMT2AMEN1GAAEPHX2
SCHEMBL2394467 0.81 EPHX2 (0.49) KMT2AMEN1LMNAEPHX2
SCHEMBL2394987 0.80 LMNA (0.34) PKMKMT2AMEN1RAB9ALMNA
SCHEMBL2392201 0.79 LMNA (0.41) LMNAGAAEPHX2
SCHEMBL2392198 0.79 EPHX2 (0.41) LMNAMAPTEPHX2
SCHEMBL2398199 0.78 LMNA (0.32) PKMKMT2AMEN1LMNAPOLB
SCHEMBL2391747 0.77 EPHX2 (0.43) LMNAEPHX2
SCHEMBL2395689 0.77 EPHX2 (0.43) LMNAEPHX2

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-8012980-B2 Isoquinolinone derivatives ASTRAZENECA AB (SE) 2011-09-06 US disclosed
EP-2344472-A1 ISOQUINOLINONE DERIVATIVES AstraZeneca AB (SE) 2011-07-20 EP disclosed
US-20100099665-A1 ISOQUINOLINONE DERIVATIVES ASTRAZENECA AB (SE) 2010-04-22 US disclosed
WO-2010039079-A1 ISOQUINOLINONE DERIVATIVES ASTRAZENECA AB (SE) 2010-04-08 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-20100099665-A1 ISOQUINOLINONE DERIVATIVES SDHA, NQO1, CYP3A5 PKM 1010/4885KMT2A 2104/4885MEN1 3451/4885

“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.