SCHEMBL908401

SCHEMBL908401

Cc1cc(C(=O)O)cnc1N1CCN(c2cc(-c3cccc(Cl)c3)nc(N3CCCC3C)c2)C(C)C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SYK P43405 9/20 0.42
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
GRM5 P41594 8/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL908403 1.00 SYK (0.42) SYKTP53POLBMAPTGRM5
SCHEMBL12903367 0.92 SYK (0.42) SYKGRM5
SCHEMBL908025 0.90 SMO (0.40) SYK
SCHEMBL908026 0.90 SMO (0.40) SYK
SCHEMBL908603 0.90 SMO (0.35) SYKTP53POLBMAPT
SCHEMBL908298 0.89 SMO (0.42) SYKGRM5
SCHEMBL908299 0.89 SMO (0.42) SYKGRM5
SCHEMBL908296 0.87 SMO (0.47) SYKMAPTPPARDPPARA
SCHEMBL908294 0.87 SMO (0.47) SYKMAPTPPARDPPARA
SCHEMBL907952 0.85 SYK (0.42) SYKMAPT

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
EP-1786800-B1 1,4-Diarylpiperazine derivatives as capsaicin receptor modulators for treating pain NEUROGEN CORP (US) 2017-01-04 EP claimed
US-20110003813-A1 SUBSTITUTED BIARYL PIPERAZINYL-PYRIDINE ANALOGUES NEUROGEN CORPORATION 2011-01-06 US claimed
US-20060122394-A1 Substituted biaryl piperazinyl-pyridine analogues NEUROGEN CORPORATION 2006-06-08 US claimed

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-20110003813-A1 SUBSTITUTED BIARYL PIPERAZINYL-PYRIDINE ANALOGUES GPR88, PIGO, PRLHR SYK 2213/4885TP53 1752/4885POLB 2744/4885
US-20060122394-A1 Substituted biaryl piperazinyl-pyridine analogues GPR88, PRLHR, GPR68 SYK 2295/4885TP53 1781/4885POLB 2837/4885

“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.