SCHEMBL25970855

SCHEMBL25970855

Cn1cc(I)c2cc(N3CC4(COC4)C3)cnc21

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.43
MET P08581 1/20 0.36
MAPK1 P28482 1/20 0.35
ACVR1 Q04771 1/20 0.32
CHRM4 P08173 2/20 0.32
HASPIN Q8TF76 1/20 0.32
CNR2 P34972 1/20 0.31
CSF1R P07333 1/20 0.31
SYK P43405 3/20 0.31
EGLN2 Q96KS0 2/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL22403197 0.85 MAPK1 (0.35) METMAPK1SYKEGLN2
SCHEMBL25970784 0.82 BRD4 (0.43) BRD4MAPK1HASPIN
SCHEMBL20504075 0.77 BRD4 (0.46) BRD4MAPK1
SCHEMBL25970869 0.77 BRD4 (0.43) BRD4MAPK1ACVR1HASPIN
SCHEMBL25970672 0.77 HTR3A (0.44) BRD4METACVR1
SCHEMBL25970628 0.77 BRD4 (0.44) BRD4METHASPIN
SCHEMBL25970829 0.76 BRD4 (0.42) BRD4METMAPK1ACVR1
SCHEMBL25970769 0.75 BRD4 (0.43) BRD4METMAPK1HASPIN
SCHEMBL25970774 0.75 BRD4 (0.43) BRD4METMAPK1HASPIN
SCHEMBL25970789 0.75 BRD4 (0.43) BRD4HASPIN

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-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors AGV DISCOVERY (FR) 2023-07-25 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-11708364-B2 Azaindole derivatives and their use as ERK kinase inhibitors MAPKAPK2, MAPK1, MAPK3 BRD4 1103/4885MET 1296/4885MAPK1 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.