SCHEMBL4778855

SCHEMBL4778855

COCCOCOCC1CN(Cc2ccccc2)CCN1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.55
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.45
HRH2 P25021 1/20 0.45
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL4780725 0.94 SIGMAR1 (0.58) SIGMAR1LMNAALDH1A1HRH2POLB
SCHEMBL64954 0.85 SIGMAR1 (0.64) SIGMAR1LMNAALDH1A1HRH2POLB
SCHEMBL22620871 0.83 SIGMAR1 (0.56) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL10678985 0.82 SIGMAR1 (0.58) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL4844073 0.82 SIGMAR1 (0.62) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL4844085 0.82 SIGMAR1 (0.62) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL7573297 0.81 SIGMAR1 (0.56) SIGMAR1LMNAALDH1A1POLB
SCHEMBL9592391 0.79 SIGMAR1 (0.55) SIGMAR1LMNA
SCHEMBL6728686 0.76 SIGMAR1 (0.55) SIGMAR1LMNAALDH1A1POLBGAA
SCHEMBL9592739 0.76 SIGMAR1 (0.60) SIGMAR1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080076924-A1 Piperazines as P2X7 antagonists ABBOTT LABORATORIES 2008-03-27 US disclosed
WO-2008005368-A2 PIPERAZINES AS P2X7 ANTAGONISTS ABBOTT LABORATORIES (US) 2008-01-10 WO 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-20080076924-A1 Piperazines as P2X7 antagonists P2RX7, P2RX1, P2RX2 SIGMAR1 256/4885LMNA 2852/4885ALDH1A1 852/4885

“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.