SCHEMBL20152899

SCHEMBL20152899

O=C(N1N=CCC1c1ccccc1)C1(F)CCN(Cl)CC1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 16/20 0.53
▸ ALDH1A1 P00352 1/20 0.50
▸ KMT2A Q03164 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ ATM Q13315 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL20152900 0.85 RIPK1 (0.54) RIPK1ALDH1A1KMT2APOLB
SCHEMBL18248300 0.84 RIPK1 (0.54) RIPK1POLB
Hydrochloric Acid SCHEMBL30018258 0.83 RIPK1 (0.53) RIPK1POLB
SCHEMBL18248365 0.81 RIPK1 (0.55) RIPK1
SCHEMBL18248370 0.77 RIPK1 (0.62) RIPK1POLB
SCHEMBL20152898 0.76 RIPK1 (0.77) RIPK1
SCHEMBL18248308 0.76 RIPK1 (0.60) RIPK1POLB
SCHEMBL23830679 0.74 RIPK1 (0.69) RIPK1ALDH1A1POLB
SCHEMBL22779612 0.74 RIPK1 (0.62) RIPK1ALDH1A1
SCHEMBL23146464 0.74 RIPK1 (0.61) RIPK1ALDH1A1POLB

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-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-05-17 — — 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-20180134665-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K1 RIPK1 414/4885ALDH1A1 1542/4885KMT2A 487/4885

“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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