SCHEMBL5533125

SCHEMBL5533125

Cc1c(C#N)cnc2sc(N)c(-c3ccc4[nH]ccc4c3)c12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRKCQ Q04759 11/20 0.43
▸ PRKCD Q05655 8/20 0.42
▸ LYN P07948 2/20 0.42
▸ BRD4 O60885 1/20 0.40
▸ LRRK2 Q5S007 3/20 0.40
▸ CDK1 P06493 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ MAP3K11 Q16584 1/20 0.38
▸ MCL1 Q07820 2/20 0.37
▸ BCL2 P10415 1/20 0.37
▸ IMPDH2 P12268 1/20 0.36
▸ IMPDH1 P20839 1/20 0.36

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
SCHEMBL5531542 0.78 IMPDH2 (0.44) PRKCQPRKCDLYNBRD4LRRK2
SCHEMBL1146649 0.77 BRD4 (0.50) PRKCQBRD4LRRK2CDK1KDR
SCHEMBL1146651 0.73 LRRK2 (0.49) PRKCQBRD4LRRK2KDRCYP3A4
SCHEMBL4951383 0.70 PRKCQ (0.69) PRKCQPRKCDLYN
SCHEMBL1146652 0.69 IMPDH2 (0.45) PRKCQBRD4LRRK2CDK1KDR
SCHEMBL5526945 0.68 PRKCQ (0.58) PRKCQPRKCDLYN
SCHEMBL5531535 0.67 IMPDH2 (0.44) PRKCQPRKCDLYNLRRK2CYP3A4
SCHEMBL5518907 0.67 PRKCQ (0.82) PRKCQPRKCDLYN
SCHEMBL7330846 0.66 NPC1 (0.58) BRD4
SCHEMBL5533123 0.66 KDR (0.37) PRKCQBRD4LRRK2CDK1KDR

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 356/4885LYN 398/4885

“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.

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