SCHEMBL4577835

SCHEMBL4577835

Cc1ccc(CC2CCN(C(=O)CNc3ccc(NS(C)(=O)=O)cc3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.53
CHRNA7 P36544 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 2/20 0.45
GRIN2D O15399 1/20 0.44
GRIN3B O60391 1/20 0.44
GRIN1 Q05586 1/20 0.44
GRIN2A Q12879 1/20 0.44
GRIN2B Q13224 1/20 0.44
GRIN2C Q14957 1/20 0.44
GRIN3A Q8TCU5 1/20 0.44
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 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
SCHEMBL4577513 0.90 CA12 (0.53) MEN1KMT2AALDH1A1GRIN1GRIN2B
SCHEMBL4591294 0.90 GRIN1 (0.51) MEN1KMT2AALDH1A1GRIN2DGRIN3B
SCHEMBL4591719 0.90 MEN1 (0.55) FAAHMEN1KMT2AALDH1A1LMNA
SCHEMBL5803633 0.85 SMN1; SMN2 (0.61) FAAHMEN1KMT2AALDH1A1GRIN1
SCHEMBL4412638 0.83 CHRNA7 (0.62) FAAHCHRNA7GRIN2DGRIN3BGRIN1
SCHEMBL9444298 0.83 POLB (0.51) FAAHALDH1A1MAPT
SCHEMBL4248473 0.81 FAAH (0.52) FAAHCHRNA7MEN1KMT2AALDH1A1
SCHEMBL4771631 0.76 GPR119 (0.59)
SCHEMBL5791545 0.76 SMN1; SMN2 (0.60) MEN1KMT2AALDH1A1GRIN1GRIN2B
SCHEMBL4577310 0.76 FAAH (0.68) FAAHMEN1KMT2AALDH1A1GRIN2D

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-7435744-B2 Piperidine derivatives as NMDA receptor antagonists GEDEON RICHTER VEGYESZETI GYAR RT (HU) 2008-10-14 US disclosed
EP-1409477-B1 PIPERIDINE DERIVATIVES AS NMDA RECEPTOR ANTAGONISTS RICHTER GEDEON NYRT (HU) 2008-09-17 EP disclosed
US-20040157886-A1 Piperdine derivatives as NMDA receptor antagonists UCB Biopharma SRL (BE) 2004-08-12 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-20040157886-A1 Piperdine derivatives as NMDA receptor antagonists GRIN1, GRIN2D, GRIN2C FAAH 835/4885CHRNA7 104/4885MEN1 2584/4885

“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.