SCHEMBL26847113

SCHEMBL26847113

Cc1ncnn2c(C(C)(C)C)ccc12

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ EGLN2 Q96KS0 1/20 0.30
▸ EGFR P00533 1/20 0.30
▸ KDR P35968 1/20 0.30

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
SCHEMBL19402915 0.80 MAP4K4 (0.41) —
SCHEMBL17175156 0.76 EGFR (0.45) ALDH1A1EGLN2EGFRKDR
SCHEMBL17253542 0.73 EGFR (0.35) KMT2AALDH1A1EGLN2EGFRKDR
SCHEMBL6844956 0.73 CHRNA7 (0.34) ALDH1A1EGLN2EGFRKDR
SCHEMBL8001535 0.73 ALDH1A1 (0.32) ALDH1A1EGLN2EGFRKDR
SCHEMBL17175025 0.70 ALDH1A1 (0.33) MEN1KMT2AALDH1A1EGLN2EGFR
SCHEMBL20276953 0.69 ALDH1A1 (0.30) ALDH1A1
SCHEMBL13412188 0.68 EGLN2 (0.49) EGLN2
SCHEMBL6370757 0.68 ALDH1A1 (0.45) ALDH1A1EGLN2
SCHEMBL12173502 0.67 MAP4K4 (0.39) —

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-20230365546-A1 5-SUBSTITUTED INDOLE 3-AMIDE DERIVATIVES, PREPARATION METHOD AND USE THEREOF ORIGIANT PHARMACEUTICAL CO., LTD (CN) 2023-11-16 — — 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-20230365546-A1 5-SUBSTITUTED INDOLE 3-AMIDE DERIVATIVES, PREPARATION METHOD AND USE THEREOF RIPK1, RIPK3, RIPK2 MEN1 1745/4885KMT2A 2607/4885ALDH1A1 3976/4885

“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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