SCHEMBL4067889

SCHEMBL4067889

CC(C)(C)[Si](C)(C)OCCN1C(=O)C(N)Cc2ccc(Cl)cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AADAT Q8N5Z0 7/20 0.49
KYAT1 Q16773 2/20 0.37
KYAT3 Q6YP21 2/20 0.37
DUT P33316 2/20 0.34
BACE1 P56817 1/20 0.33
GOT1 P17174 1/20 0.32
HTR2A P28223 2/20 0.31
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 0.31
GRM5 P41594 1/20 0.31
PYGL P06737 2/20 0.31
MEN1 O00255 1/20 0.31
SLC22A1 O15245 1/20 0.31
ABCB11 O95342 1/20 0.31
TP53 P04637 1/20 0.31
CYP1A2 P05177 1/20 0.31
ADRB2 P07550 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
ADRB1 P08588 1/20 0.31

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
SCHEMBL13878903 1.00 AADAT (0.49) AADATKYAT1KYAT3DUTBACE1
SCHEMBL13878891 0.87 AADAT (0.37) AADATKYAT1KYAT3DUTBACE1
SCHEMBL4071623 0.87 AADAT (0.37) AADATKYAT1KYAT3DUTBACE1
SCHEMBL4070055 0.86 AADAT (0.38) AADATDUTBACE1HTR2AHTR2C
SCHEMBL4067683 0.84 AADAT (0.45) AADATKYAT1KYAT3DUTGOT1
SCHEMBL4067713 0.84 AADAT (0.45) AADATKYAT1KYAT3DUTGOT1
SCHEMBL4072394 0.78 AADAT (0.43) AADATKYAT1KYAT3DUTGOT1
SCHEMBL4063660 0.77 AADAT (0.64) AADATKYAT1KYAT3GOT1HTR2A
SCHEMBL4063334 0.75 DUT (0.34) AADATDUTMEN1KMT2A
SCHEMBL13878908 0.74 PYGL (0.53) PYGLABCB11

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-20090099176-A1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LIMITED (GB) 2009-04-16 US disclosed
EP-1819332-B1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LTD (GB) 2009-03-11 EP disclosed
EP-1819332-A2 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES Prosidion Limited (GB) 2007-08-22 EP disclosed
WO-2006059164-A2 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PROSIDION LIMITED (GB) 2006-06-08 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-20090099176-A1 PYRROLOPYRIDINE-2-CARBOXYLIC ACID AMIDES PC, GOT2, PDK1 AADAT 426/4885KYAT1 542/4885KYAT3 1050/4885

“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.