SCHEMBL2397981

SCHEMBL2397981

CC(C)(CO[Si](C)(C)C(C)(C)C)Cn1cc(S(=O)(=O)N2CC[C@H](NC(=O)O)C2)c2cc(Br)ccc2c1=O

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.37
TP53 P04637 2/20 0.37
RXFP1 Q9HBX9 1/20 0.37
LMNA P02545 2/20 0.34
ALDH1A1 P00352 3/20 0.34
POLB P06746 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
BRD4 O60885 2/20 0.33
MMP2 P08253 1/20 0.33
MMP13 P45452 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX2 P34913 1/20 0.33
TSHR P16473 1/20 0.32
ADRA2A P08913 1/20 0.32
NPY5R Q15761 1/20 0.32
MCHR1 Q99705 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
SCHEMBL2392634 1.00 MAPT (0.37) MAPTTP53RXFP1LMNAALDH1A1
SCHEMBL12259614 0.92 BRD4 (0.43) MAPTTP53RXFP1ALDH1A1MEN1
SCHEMBL12259615 0.92 BRD4 (0.43) MAPTTP53RXFP1ALDH1A1MEN1
SCHEMBL2392828 0.83 MAPT (0.33) MAPTTP53RXFP1LMNAALDH1A1
SCHEMBL2392517 0.82 RAB9A (0.38)
SCHEMBL2395685 0.82 MAPK14 (0.41)
SCHEMBL2390156 0.82 MAPK14 (0.41)
SCHEMBL1725753 0.81 MAPT (0.35) MAPTTP53RXFP1LMNAALDH1A1
SCHEMBL2394669 0.79 MAPT (0.33) MAPT
SCHEMBL2394672 0.78 MAPT (0.32) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8012980-B2 Isoquinolinone derivatives ASTRAZENECA AB (SE) 2011-09-06 US disclosed
US-20100099665-A1 ISOQUINOLINONE DERIVATIVES ASTRAZENECA AB (SE) 2010-04-22 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-20100099665-A1 ISOQUINOLINONE DERIVATIVES SDHA, NQO1, CYP3A5 MAPT 955/4885TP53 653/4885RXFP1 4102/4885

“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.