SCHEMBL21144967

SCHEMBL21144967

Cc1cc(CC(CN2C(=O)c3ccccc3C2=O)NC(=O)O)ccc1C#N

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.40
CTSB P07858 1/20 0.39
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
THRB P10828 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
POLB P06746 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36

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
SCHEMBL21144964 1.00 MME (0.40) MMECTSBPRMT5WDR77KMT2A
SCHEMBL18930478 0.87 PTPN1 (0.44) CTSB
SCHEMBL21144784 0.84 MMP2 (0.44) MMEALDH1A1GAAHDAC1HDAC7
SCHEMBL21144781 0.84 MMP2 (0.44) MMEALDH1A1GAAHDAC1HDAC7
SCHEMBL16165445 0.81 ALDH1A1 (0.50) KMT2AALDH1A1MEN1GAAL3MBTL1
SCHEMBL18930457 0.81 PRMT5 (0.39) PRMT5WDR77KMT2AALDH1A1GAA
SCHEMBL18920544 0.80 CYP3A4 (0.42) MMECTSBMRGPRX4
SCHEMBL21144944 0.80 CYP3A4 (0.42) MMECTSBMRGPRX4
Hydrochloric Acid SCHEMBL21144856 0.80 PRMT5 (0.39) PRMT5WDR77KMT2AALDH1A1GAA
Hydrochloric Acid SCHEMBL21144854 0.80 PRMT5 (0.39) PRMT5WDR77KMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-05-19 US disclosed
EP-3383865-B1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 Bayer Pharma AG (DE) 2020-01-29 EP disclosed
US-20190218196-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-07-18 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 (2 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-20190218196-A1 FURANE DERIVATIVES AS INHIBITORS OF ATAD2 ATAD2, ATAD2B, TAF1L MME 4530/4885CTSB 3425/4885PRMT5 260/4885
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 ATAD2, ATAD2B, TAF1L MME 4530/4885CTSB 3425/4885PRMT5 260/4885

“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.