SCHEMBL4876867

SCHEMBL4876867

O=C(NCCN1CCN(Cc2ccccc2)CC1)[C@@H]1C[C@H]1c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 1.00
PLD2 O14939 2/20 0.57
PLD1 Q13393 2/20 0.57
TSHR P16473 2/20 0.56
POLB P06746 1/20 0.56
CYP2D6 P10635 1/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
DRD2 P14416 1/20 0.53
DRD3 P35462 1/20 0.53

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
SCHEMBL4876861 1.00 SIGMAR1 (1.00) SIGMAR1PLD2PLD1TSHRPOLB
SCHEMBL4875709 0.89 SIGMAR1 (1.00) SIGMAR1PLD2PLD1MEN1KMT2A
SCHEMBL4875721 0.89 SIGMAR1 (1.00) SIGMAR1PLD2PLD1MEN1KMT2A
SCHEMBL4870310 0.87 SIGMAR1 (1.00) SIGMAR1PLD2PLD1POLBMEN1
SCHEMBL4870315 0.87 SIGMAR1 (1.00) SIGMAR1PLD2PLD1POLBMEN1
SCHEMBL4867118 0.86 SIGMAR1 (0.97) SIGMAR1PLD2PLD1POLBMEN1
SCHEMBL4871963 0.84 SIGMAR1 (0.79) SIGMAR1PLD2PLD1TSHRDRD2
SCHEMBL12916046 0.79 SIGMAR1 (0.64) SIGMAR1KMT2A
SCHEMBL5180920 0.78 SIGMAR1 (0.80) SIGMAR1PLD2PLD1POLBMEN1
SCHEMBL5180929 0.78 SIGMAR1 (0.80) SIGMAR1PLD2PLD1POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153917-A1 Sigma Receptor Ligands UCB PHARMA, S.A. (BE) 2008-06-26 US claimed
EP-1797036-A1 SIGMA RECEPTOR LIGANDS UCB Pharma, S.A. (BE) 2007-06-20 EP claimed
WO-2006027252-A1 SIGMA RECEPTOR LIGANDS UCB PHARMA, SA (BE) 2006-03-16 WO claimed
US-20080153917-A1 Sigma Receptor Ligands UCB PHARMA, S.A. (BE) 2008-06-26 US disclosed
EP-1797036-A1 SIGMA RECEPTOR LIGANDS UCB Pharma, S.A. (BE) 2007-06-20 EP disclosed
WO-2006027252-A1 SIGMA RECEPTOR LIGANDS UCB PHARMA, SA (BE) 2006-03-16 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-20080153917-A1 Sigma Receptor Ligands SIGMAR1, TMEM97, OPRL1 SIGMAR1 1/4885PLD2 1203/4885PLD1 2266/4885

“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.