SCHEMBL2980684

SCHEMBL2980684

COc1cccc(Nc2cccc3ncccc23)c1OC

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAK O14976 4/20 0.58
RIPK2 O43353 2/20 0.58
COQ8A Q8NI60 2/20 0.58
NLK Q9UBE8 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
HSD17B10 Q99714 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
KDM4E B2RXH2 2/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
BRAF P15056 1/20 0.47
HTT P42858 1/20 0.47
SYK P43405 1/20 0.47
LMNA P02545 1/20 0.47
RECQL P46063 1/20 0.46
CCR4 P51679 1/20 0.45
POLB P06746 1/20 0.44

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
SCHEMBL30307397 0.81 GAK (0.66) GAKRIPK2COQ8ANLKL3MBTL1
SCHEMBL19283173 0.81 GAK (0.66) GAKRIPK2COQ8ANLKL3MBTL1
SCHEMBL29096082 0.79 SYK (0.57) GAKRIPK2COQ8ANLKSMN1; SMN2
SCHEMBL96953 0.79 SYK (0.57) GAKRIPK2COQ8ANLKSMN1; SMN2
SCHEMBL27797044 0.78 SYK (0.56) GAKRIPK2COQ8ANLKSMN1; SMN2
SCHEMBL21264425 0.75 MEN1 (0.55) RIPK2SMN1; SMN2L3MBTL1KDM4EMAPT
SCHEMBL460384 0.75 SYK (0.57) GAKRIPK2COQ8ANLKSMN1; SMN2
SCHEMBL6126214 0.74 SMN1; SMN2 (0.64) SMN1; SMN2HSD17B10L3MBTL1KDM4EMAPT
SCHEMBL1172280 0.74 IGF1R (0.67) GAKRIPK2COQ8ANLKSMN1; SMN2
SCHEMBL8976490 0.74 RET (0.65)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029543-B1 SUBSTITUTED 3-CYANOPYRIDINES AS PROTEIN KINASE INHIBITORS WYETH LLC (US) 2015-11-18 EP disclosed
US-7781591-B2 Substituted 3-cyanopyridines as protein kinase inhibitors WYETH LLC (US) 2010-08-24 US disclosed
US-20070287708-A1 Substituted 3-cyanopyridines as protein kinase inhibitors WYETH LLC 2007-12-13 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-20070287708-A1 Substituted 3-cyanopyridines as protein kinase inhibitors CNKSR1, MAP3K1, MAP3K7 GAK 267/4885RIPK2 143/4885COQ8A 728/4885

“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.