SCHEMBL29336676

SCHEMBL29336676

CC(=O)c1c(Oc2cccc(C#N)c2)ccc2[nH]ccc12

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.45
▸ RHEB Q15382 2/20 0.41
▸ EPAS1 Q99814 8/20 0.40
▸ AR P10275 1/20 0.39
▸ EGFR P00533 1/20 0.39
▸ ERBB2 P04626 1/20 0.39
▸ ERBB3 P21860 1/20 0.39
▸ ERBB4 Q15303 1/20 0.39
▸ VEGFA P15692 4/20 0.38
▸ DHPS P49366 1/20 0.37
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ TBXA2R P21731 1/20 0.37

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
SCHEMBL29337679 0.89 BRD4 (0.44) BRD4RHEBEPAS1AREGFR
SCHEMBL30217170 0.89 BRD4 (0.44) BRD4RHEBEPAS1AREGFR
SCHEMBL30967840 0.82 PRKCQ (0.47) BRD4RHEBEPAS1AREGFR
SCHEMBL27275421 0.82 PRKCQ (0.47) BRD4RHEBEPAS1AREGFR
SCHEMBL30967802 0.80 EPAS1 (0.49) BRD4RHEBEPAS1AREGFR
SCHEMBL29237661 0.80 EPAS1 (0.49) BRD4RHEBEPAS1AREGFR
SCHEMBL27275422 0.80 EPAS1 (0.49) BRD4RHEBEPAS1AREGFR
SCHEMBL30967931 0.79 BRD4 (0.46) BRD4RHEBEPAS1AREGFR
SCHEMBL29237251 0.79 BRD4 (0.46) BRD4RHEBEPAS1AREGFR
SCHEMBL29337971 0.79 BRD4 (0.46) BRD4RHEBEPAS1AREGFR

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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE GENZYME CORPORATION 2024-07-18 — — 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-20240239784-A1 INDOLE COMPOUNDS AND METHODS OF USE CFTR, INMT, IDO1 BRD4 651/4885RHEB 3259/4885EPAS1 2305/4885

“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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