SCHEMBL19654491

SCHEMBL19654491

Cc1cnc(Nc2ccc3nc[nH]c3c2)nc1Nc1cc(C2CCC2)[nH]n1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ULK1 O75385 3/20 0.71
▸ PDK1 Q15118 1/20 0.71
▸ ULK2 Q8IYT8 1/20 0.71
▸ IGF1R P08069 14/20 0.62
▸ NTRK1 P04629 1/20 0.51
▸ CDK1 P06493 2/20 0.50

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
SCHEMBL17544877 0.87 CDK1 (0.68) ULK1PDK1ULK2IGF1RCDK1
SCHEMBL30099800 0.83 ULK1 (1.00) ULK1PDK1ULK2IGF1RNTRK1
SCHEMBL15256327 0.79 IGF1R (0.79) IGF1RNTRK1
SCHEMBL20438003 0.79 NEK1 (0.67) ULK1PDK1ULK2IGF1R
SCHEMBL19654400 0.78 ULK1 (0.72) ULK1ULK2CDK1
SCHEMBL15217712 0.78 IGF1R (0.57) IGF1RNTRK1
SCHEMBL19654471 0.78 IGF1R (0.60) ULK1IGF1RNTRK1
SCHEMBL15580694 0.77 IGF1R (1.00) IGF1RNTRK1
SCHEMBL15109533 0.76 IGF1R (0.79) IGF1R
SCHEMBL15217683 0.76 NTRK1 (0.72) IGF1RNTRK1

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-20170342088-A1 NOVEL ULK1 INHIBITORS AND METHODS USING SAME SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2017-11-30 — — 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-20170342088-A1 NOVEL ULK1 INHIBITORS AND METHODS USING SAME ULK1, ULK2, ULK3 ULK1 1/4885PDK1 382/4885ULK2 2/4885

“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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