SCHEMBL21144802

SCHEMBL21144802

CON(C)C(=O)CC(Cc1ccc(C#N)cc1)NC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.42
MME P08473 2/20 0.40
HTT P42858 1/20 0.39
ACACB O00763 3/20 0.38
NLRP3 Q96P20 1/20 0.38
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
FAAH O00519 1/20 0.37
SNCA P37840 1/20 0.36
PTGER4 P35408 1/20 0.36
MMP12 P39900 1/20 0.36
MMP13 P45452 1/20 0.36
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTSG P08311 1/20 0.36
MMP2 P08253 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
SCHEMBL21144799 1.00 MAOB (0.42) MAOBMMEHTTACACBNLRP3
SCHEMBL21144709 0.88 MAOB (0.43) MAOBMMEHTTACACBMMP12
SCHEMBL21144706 0.88 MAOB (0.43) MAOBMMEHTTACACBMMP12
SCHEMBL18930458 0.85 ATM (0.44) MAOB
SCHEMBL2197304 0.85 CYP3A4 (0.43) MME
SCHEMBL18577074 0.84 MME (0.46) MAOBMMEFAAH
SCHEMBL18577072 0.84 MME (0.46) MAOBMMEFAAH
SCHEMBL21144895 0.80 MAOB (0.44) MAOBMMEHTTACACB
SCHEMBL21144897 0.80 MAOB (0.44) MAOBMMEHTTACACB
SCHEMBL21144663 0.80 ACACB (0.54) MAOBMMEHTTACACBNLRP3

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 MAOB 1713/4885MME 4530/4885HTT 2336/4885
US-10654818-B2 Furane derivatives as inhibitors of ATAD2 ATAD2, ATAD2B, TAF1L MAOB 1713/4885MME 4530/4885HTT 2336/4885

“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.