SCHEMBL30076104

SCHEMBL30076104

Oc1ccc(CCN2C[C@H]3CC(Cc4ccccc4)C[C@H]3C2)cc1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 11/20 0.63
▸ CCR3 P51677 1/20 0.52
▸ GRIN2D O15399 2/20 0.48
▸ GRIN3B O60391 2/20 0.48
▸ ADRA1D P25100 2/20 0.48
▸ ADRA1A P35348 2/20 0.48
▸ ADRA1B P35368 2/20 0.48
▸ GRIN1 Q05586 2/20 0.48
▸ GRIN2A Q12879 2/20 0.48
▸ GRIN2C Q14957 2/20 0.48
▸ GRIN3A Q8TCU5 2/20 0.48

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
SCHEMBL18629293 0.89 GRIN2B (0.67) GRIN2B
SCHEMBL20858825 0.86 CCR3 (0.52) GRIN2BCCR3
SCHEMBL23805631 0.83 GRIN2B (0.59) GRIN2B
SCHEMBL24866256 0.82 GRIN2B (0.62) GRIN2BGRIN2DGRIN3BADRA1DADRA1A
SCHEMBL24866251 0.81 GRIN2B (0.60) GRIN2B
SCHEMBL7407241 0.80 CCR3 (0.82) GRIN2BCCR3GRIN2DGRIN3BADRA1D
SCHEMBL7523207 0.80 SLC6A3 (0.57) CCR3
SCHEMBL23805618 0.80 GRIN2B (0.62) GRIN2BGRIN2DGRIN3BADRA1DADRA1A
SCHEMBL23805595 0.80 GRIN2B (0.62) GRIN2BGRIN2DGRIN3BADRA1DADRA1A
SCHEMBL23805564 0.80 GRIN2B (0.62) GRIN2BGRIN2DGRIN3BADRA1DADRA1A

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-12161624-B2 Selective octahydro-cyclopenta[c]pyrrole negative modulators of NR2B NOVARTIS AG (CH) 2024-12-10 — — US disclosed
US-20230012073-A1 SELECTIVE OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE MODULATORS OF NR2B CADENT THERAPEUTICS, INC. (US) 2023-01-12 — — 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 (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-20230012073-A1 SELECTIVE OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE MODULATORS OF NR2B GRIN2A, GRIN2C, GRIN3A GRIN2B 4/4885CCR3 3425/4885GRIN2D 9/4885
US-12161624-B2 Selective octahydro-cyclopenta[c]pyrrole negative modulators of NR2B GRIN2A, GRIN2C, GRIN3A GRIN2B 4/4885CCR3 3425/4885GRIN2D 9/4885

“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.

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