SCHEMBL2114128

SCHEMBL2114128

Cn1nccc1C(O)c1cncc(Br)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 1/20 0.34
KCNH2 Q12809 1/20 0.34
POLB P06746 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
HTT P42858 4/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
ALOX15 P16050 1/20 0.33
SYK P43405 1/20 0.32
RAB9A P51151 1/20 0.31
LMNA P02545 2/20 0.31
GAA P10253 2/20 0.30
IDO1 P14902 1/20 0.30
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNA4 P43681 1/20 0.30
ROCK2 O75116 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALOX12 P18054 1/20 0.30

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
SCHEMBL17865262 0.82 KCNH2 (0.40) PRKDCKCNH2HCAR2HTTSMN1; SMN2
SCHEMBL17865255 0.82 PRKDC (0.38) PRKDCKCNH2HCAR2SMN1; SMN2SYK
SCHEMBL6920072 0.80 MAPK1 (0.45) PRKDCKCNH2SMN1; SMN2LMNAIDO1
SCHEMBL17861201 0.77 SMN1; SMN2 (0.59) SMN1; SMN2LMNAGAAALDH1A1
SCHEMBL17865259 0.76 CYP3A4 (0.42) PRKDCKCNH2SMN1; SMN2LMNAGAA
SCHEMBL7590836 0.74 KDM4E (0.50) POLBHTTSMN1; SMN2LMNAALDH1A1
SCHEMBL7589137 0.74 KDM4E (0.50) POLBHTTSMN1; SMN2LMNAALDH1A1
SCHEMBL2788882 0.74 KDM4E (0.50) POLBHTTSMN1; SMN2LMNAALDH1A1
SCHEMBL29735217 0.73 SMN1; SMN2 (0.56) POLBHCAR2HTTSMN1; SMN2ALOX15
SCHEMBL3842759 0.73 SMN1; SMN2 (0.56) POLBHCAR2HTTSMN1; SMN2ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158647-B2 Substituted pyrrolopyridines and pyrazolopyridines as kinase modulators SGX PHARMACEUTICALS, INC. (US) 2012-04-17 US disclosed
US-8158647-B2 Substituted pyrrolopyridines and pyrazolopyridines as kinase modulators SGX PHARMACEUTICALS, INC. (US) 2012-04-17 US disclosed
US-8158647-B2 Substituted pyrrolopyridines and pyrazolopyridines as kinase modulators SGX PHARMACEUTICALS, INC. (US) 2012-04-17 US disclosed
CN-101778629-A Substituted pyrrolopyridine and pyrazolopyridine compounds useful as kinase modulators SGX PHARMACEUTICALS INC 2010-07-14 CN disclosed
EP-2056822-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS SGX Pharmaceuticals, Inc. (US) 2009-05-13 EP disclosed
US-20090005356-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2009-01-01 US disclosed
US-20090005356-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2009-01-01 US disclosed
US-20090005356-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2009-01-01 US disclosed
WO-2008150914-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-12-11 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-20090005356-A1 SUBSTITUTED PYRROLOPYRIDINES AND PYRAZOLOPYRIDINES AS KINASE MODULATORS PDXK, MAP3K4, PDPK1 PRKDC 349/4885KCNH2 1042/4885POLB 2096/4885

“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.