SCHEMBL3148317

SCHEMBL3148317

CC(C)Oc1ccc(-c2nn(C(N)=O)c3cc[c]cc23)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.39
RORC P51449 2/20 0.38
GLA P06280 1/20 0.36
MAPT P10636 2/20 0.36
CASR P41180 1/20 0.36
BTK Q06187 5/20 0.35
MCL1 Q07820 4/20 0.35
BCL2 P10415 3/20 0.35
MDM2 Q00987 3/20 0.35
KMT2A Q03164 1/20 0.34
TP53 P04637 1/20 0.33

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
SCHEMBL15662428 0.85 MAPK1 (0.35) RORC
SCHEMBL3407549 0.82 MAPK1 (0.36) RORC
SCHEMBL3152349 0.81 CHEK2 (0.39) BTKTP53
SCHEMBL3138154 0.81 RORC (0.36) RORCMAPTTP53
SCHEMBL4221224 0.81 RORC (0.36) RORCMAPTTP53
SCHEMBL15662904 0.75 RORC (0.32) RORC
SCHEMBL15662420 0.75 MAPT (0.37) MAPT
SCHEMBL4222585 0.74 MAPK1 (0.39)
SCHEMBL15661778 0.73 PKN1 (0.36)
SCHEMBL15661362 0.72 PIK3CA (0.36)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8546404-B2 Compounds that are ERK inhibitors MERCK SHARP & DOHME (US) 2013-10-01 US disclosed
EP-2155722-B1 POLYCYCLIC INDAZOLE DERIVATIVES AND THEIR USE AS ERK INHIBITORS FOR THE TREATMENT OF CANCER MERCK SHARP & DOHME (US) 2013-08-14 EP disclosed
EP-2155722-A1 POLYCYCLIC INDAZOLE DERIVATIVES AND THEIR USE AS ERK INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORPORATION (US) 2010-02-24 EP disclosed
US-20090118284-A1 Novel compounds that are ERK inhibitors MERCK SHARP & DOHME LLC 2009-05-07 US disclosed
WO-2008153858-A1 POLYCYCLIC INDAZOLE DERIVATIVES AND THEIR USE AS ERK INHIBITORS FOR THE TREATMENT OF CANCER SCHERING CORPORATION (US) 2008-12-18 WO 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-20090118284-A1 Novel compounds that are ERK inhibitors MAPK1, MAPK4, MAPK10 PARP10 949/4885RORC 2751/4885GLA 4096/4885

“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.