SCHEMBL15938494

SCHEMBL15938494

Cc1ccc(C(N)=O)cc1Nc1ncc(C(F)(F)F)c(Nc2ccccc2NC(=O)O)n1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 17/20 0.73
CDC7 O00311 1/20 0.56
ROCK2 O75116 1/20 0.56
MAP4K4 O95819 1/20 0.56
PIM1 P11309 1/20 0.56
PRKACA P17612 1/20 0.56
CDK7 P50613 1/20 0.56
CDK9 P50750 1/20 0.56
HIPK2 Q9H2X6 1/20 0.56
IRAK4 Q9NWZ3 1/20 0.56
PTK2 Q05397 2/20 0.55

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
SCHEMBL18469802 0.94 MAPK3 (0.69) MAPK3CDC7ROCK2MAP4K4PIM1
SCHEMBL15938024 0.91 MAPK3 (0.85) MAPK3
SCHEMBL15948507 0.89 MAPK3 (0.66) MAPK3PTK2
SCHEMBL17102738 0.85 MAPK3 (0.59) MAPK3CDC7ROCK2MAP4K4PIM1
SCHEMBL15938332 0.84 MAPK3 (1.00) MAPK3
SCHEMBL12998733 0.84 MAPK3 (0.59) MAPK3CDC7ROCK2MAP4K4PIM1
SCHEMBL12998734 0.84 MAPK3 (0.59) MAPK3CDC7ROCK2MAP4K4PIM1
SCHEMBL12998725 0.83 MAPK3 (0.58) MAPK3CDC7ROCK2MAP4K4PIM1
SCHEMBL12998728 0.83 MAPK3 (0.58) MAPK3CDC7ROCK2MAP4K4PIM1
SCHEMBL12998726 0.83 MAPK3 (0.58) MAPK3CDC7ROCK2MAP4K4PIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2953457-B1 ERK INHIBITORS AND USES THEREOF CELGENE CAR LLC (BM) 2020-04-08 EP disclosed
US-9980964-B2 ERK inhibitors and uses thereof CELGENE CAR LLC (BM) 2018-05-29 US disclosed
US-9796700-B2 ERK inhibitors and uses thereof CELGENE CAR LLC (BM) 2017-10-24 US disclosed
US-20170210729-A1 ERK INHIBITORS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2017-07-27 US disclosed
US-20170137406-A1 ERK INHIBITORS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2017-05-18 US disclosed
EP-2953457-A2 ERK INHIBITORS AND USES THEREOF Celgene Avilomics Research, Inc. (US) 2015-12-16 EP disclosed
WO-2014124230-A2 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-08-14 WO disclosed
US-20140228322-A1 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-08-14 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 (3 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-20170137406-A1 ERK INHIBITORS AND USES THEREOF MAP3K20, MAP3K1, MAPK3 MAPK3 3/4885CDC7 331/4885ROCK2 183/4885
US-20170210729-A1 ERK INHIBITORS AND USES THEREOF MAP3K20, MAP3K1, MAPK3 MAPK3 3/4885CDC7 331/4885ROCK2 183/4885
US-20140228322-A1 ERK INHIBITORS AND USES THEREOF MAP3K20, MAP3K1, MAPK3 MAPK3 3/4885CDC7 331/4885ROCK2 183/4885

“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.