SCHEMBL4934089

SCHEMBL4934089

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nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRA4 P48169 2/20 0.33
GABRE P78334 2/20 0.33
GABRA6 Q16445 2/20 0.33
GABRG1 Q8N1C3 2/20 0.33
GABRG3 Q99928 2/20 0.33
GABRQ Q9UN88 2/20 0.33

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
SCHEMBL4934096 1.00 GABRP (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4934086 1.00 GABRP (0.33) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4936524 0.81 GABRP (0.31) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4936532 0.81 GABRP (0.31) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4936518 0.81 GABRP (0.31) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4937720 0.78 GRIK1 (0.32) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4937711 0.78 GRIK1 (0.32) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL4937710 0.78 GRIK1 (0.32) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9698701 0.78 KDM4E (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9698697 0.78 KDM4E (0.38) GABRPGABRDGABRA1GABRB1GABRG2

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-20080194841-A1 Preparation of Optically Pure Beta-Amino Acids Having Affinity for the Alpha-Delta Protein PFIZER INC. 2008-08-14 US claimed
US-20080194841-A1 Preparation of Optically Pure Beta-Amino Acids Having Affinity for the Alpha-Delta Protein PFIZER INC. 2008-08-14 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-20080194841-A1 Preparation of Optically Pure Beta-Amino Acids Having Affinity for the Alpha-Delta Protein OPRD1, CHRND, CHRNE GABRP 86/4885GABRD 218/4885GABRA1 167/4885

“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.