SCHEMBL5761733

SCHEMBL5761733

Cc1coc(-c2ccc(N3CCC(Oc4cccnc4N4CCN(C)CC4)C3=O)cc2)n1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.37
ROCK2 O75116 2/20 0.36
MCHR1 Q99705 8/20 0.35
KDM4E B2RXH2 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL5807850 0.93 PIK3CD (0.33) ELANEROCK2MCHR1
SCHEMBL5762196 0.87 CHRNA7 (0.39) ELANEROCK2MCHR1
SCHEMBL5846130 0.86 POLB (0.39) ELANEROCK2MCHR1
SCHEMBL5846134 0.86 ELANE (0.41) ELANE
SCHEMBL5762922 0.84 MCHR1 (0.47) ROCK2MCHR1KDM4ERAB9AL3MBTL1
SCHEMBL5762169 0.82 MCHR1 (0.38) ELANEROCK2MCHR1
SCHEMBL5760136 0.81 ROCK2 (0.51) ROCK2MCHR1
SCHEMBL5790143 0.81 ROCK2 (0.39) ROCK2MCHR1
SCHEMBL5759920 0.80 TRPV1 (0.42) ROCK2MCHR1
SCHEMBL5763103 0.79 HPGD (0.43) ROCK2KDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1638932-A1 NOVEL PIPERAZINYL-ARYLOXY AND PIPERAZINYL-HETEROARYLOXY-N-ARYL LACTAMS Pfizer Products Inc. (US) 2006-03-29 EP claimed
US-20040266781-A1 Novel piperazinyl-aryloxy and piperazinyl-heteroaryloxy-n-aryl lactams PFIZER INC 2004-12-30 US claimed
WO-2004110994-A1 NOVEL PIPERAZINYL-ARYLOXY AND PIPERAZINYL-HETEROARYLOXY-N-ARYL LACTAMS PFIZER PRODUCTS INC. (US) 2004-12-23 WO claimed
US-20040266781-A1 Novel piperazinyl-aryloxy and piperazinyl-heteroaryloxy-n-aryl lactams PFIZER INC 2004-12-30 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 (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-20040266781-A1 Novel piperazinyl-aryloxy and piperazinyl-heteroaryloxy-n-aryl lactams OPRD1, HTR5A, PTGDR ELANE 4255/4885ROCK2 3762/4885MCHR1 646/4885

“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.