SCHEMBL9927079

SCHEMBL9927079

CC(C)C(=O)c1nc(C(F)(F)F)cs1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSK P43235 1/20 0.44
FFAR2 O15552 1/20 0.41
CBLB Q13191 2/20 0.38
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
IRAK4 Q9NWZ3 3/20 0.34
PTGES O14684 2/20 0.33
OGA O60502 1/20 0.33
FABP4 P15090 2/20 0.32
FABP5 Q01469 2/20 0.32
LIMK1 P53667 1/20 0.32
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
PTGER1 P34995 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
SCHEMBL13044094 0.84 ATAD2 (0.41) FFAR2MEN1KMT2ALMNAHPGD
SCHEMBL9928614 0.80 ALDH1A1 (0.38) CTSKFFAR2CBLBMEN1KMT2A
SCHEMBL312511 0.78 FABP4 (0.36) CTSKFFAR2CBLBMEN1KMT2A
SCHEMBL577680 0.77 CYP3A4 (0.39) CTSKFFAR2CBLBMEN1KMT2A
SCHEMBL578067 0.77 FFAR2 (0.38) CTSKFFAR2CBLBMEN1KMT2A
SCHEMBL1989340 0.76 MEN1 (0.35) CTSKFFAR2CBLBMEN1KMT2A
SCHEMBL20993710 0.75 CTSK (0.49) CTSKFFAR2IRAK4PTGES
SCHEMBL6840492 0.74 HSD17B10 (0.43) FFAR2KMT2ALMNAHPGDHTT
Acetic Acid SCHEMBL15573175 0.72 MEN1 (0.35) CTSKFFAR2CBLBMEN1KMT2A
SCHEMBL485822 0.72 ALDH1A1 (0.44) CTSKMEN1KMT2AHPGD

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-10640506-B2 Cyclobutyl substituted pyrrolopyridine and pyrrolopyrimidines derivatives as JAK inhibitors INCYTE HOLDINGS CORPORATION (US) 2020-05-05 US disclosed
US-20190135813-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION 2019-05-09 US disclosed
US-20150087632-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION (US) 2015-03-26 US disclosed
US-8933085-B2 Cyclobutyl substituted pyrrolopyridine and pyrrolopyrimidine derivatives as JAK inhibitors INCYTE CORPORATION (US) 2015-01-13 US disclosed
US-20120149681-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION 2012-06-14 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 (4 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-10640506-B2 Cyclobutyl substituted pyrrolopyridine and pyrrolopyrimidines derivatives as JAK inhibitors JAK2, JAK1, JAK3 CTSK 2584/4885FFAR2 3869/4885CBLB 342/4885
US-20120149681-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 CTSK 2596/4885FFAR2 3798/4885CBLB 261/4885
US-20150087632-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS JAK2, JAK1, JAK3 CTSK 2584/4885FFAR2 3869/4885CBLB 342/4885
US-20190135813-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS JAK2, JAK1, JAK3 CTSK 2584/4885FFAR2 3869/4885CBLB 342/4885

“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.