SCHEMBL5520893

SCHEMBL5520893

CN1CCN(Cc2ccc(-c3cc4cc(C#N)cnc4s3)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCQ Q04759 3/20 0.53
PRKCD Q05655 3/20 0.53
SRC P12931 7/20 0.48
TNIK Q9UKE5 3/20 0.48
ABL1 P00519 1/20 0.46
ABL2 P42684 1/20 0.46
CHKA P35790 2/20 0.45
CHEK1 O14757 1/20 0.43
HRH3 Q9Y5N1 2/20 0.42
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
TBK1 Q9UHD2 1/20 0.40

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
SCHEMBL5518287 0.74 JAK2 (0.44) PRKCQPRKCD
SCHEMBL1939129 0.73 AKT1 (0.64) TNIKCHKA
SCHEMBL148919 0.72 KCNJ1 (0.61) CHKAHRH3
SCHEMBL5520897 0.69 CHKA (0.48) PRKCQPRKCDSRCTNIKABL1
SCHEMBL28805850 0.68 CHEK1 (0.45) SRCABL1ABL2CHKACHEK1
SCHEMBL29809149 0.67 HRH3 (0.60) TNIKCHKAHRH3
SCHEMBL1482500 0.67 HRH3 (0.60) TNIKCHKAHRH3
SCHEMBL21633114 0.67 KCNJ1 (0.54) CHKAHRH3
SCHEMBL151521 0.67 CHKA (0.69) CHKAHRH3
SCHEMBL4946592 0.67 SRC (0.64) PRKCQPRKCDSRCABL1CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070082880-A1 Thieno [2,3-B] pyridine-5-carbonitriles as protein kinase inhibitors WYETH 2007-04-12 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-20070082880-A1 Thieno [2,3-B] pyridine-5-carbonitriles as protein kinase inhibitors MAP4K2, CNKSR1, MAP3K1 PRKCQ 286/4885PRKCD 356/4885SRC 370/4885

“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.