SCHEMBL22011729

SCHEMBL22011729

CC(C)CN1CC2C(C1)C2(F)F

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.47
CYP2D6 P10635 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL24995746 0.79 PIK3CD (0.48) PIK3CDCYP2D6SMN1; SMN2
SCHEMBL18926695 0.75 PIK3CD (0.58) PIK3CDCYP2D6SMN1; SMN2
SCHEMBL18505950 0.73 ATM (0.40)
SCHEMBL16941607 0.73
SCHEMBL11998897 0.70 PIK3CD (0.38) PIK3CDCYP2D6SMN1; SMN2
SCHEMBL10446321 0.70
SCHEMBL23740711 0.70 PIK3CD (0.54) PIK3CDCYP2D6SMN1; SMN2
SCHEMBL19362302 0.70 PIK3CD (0.48) PIK3CD
SCHEMBL24841690 0.70 PIK3CD (0.48) PIK3CD
SCHEMBL12369900 0.70 PIK3CD (0.40) PIK3CDCYP2D6SMN1; SMN2

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-20220016105-A1 BIASED NMDA RECEPTOR MODULATORS AND USES THEREOF EDWARD Via COLLEGE OF OSTEOPATHIC MEDICINE 2022-01-20 US disclosed
WO-2020102443-A1 BIASED NMDA RECEPTOR MODULATORS AND USES THEREOF EDWARD Via COLLEGE OF OSTEOPATHIC MEDICINE (US) 2020-05-22 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-20220016105-A1 BIASED NMDA RECEPTOR MODULATORS AND USES THEREOF GRIN1, GRIN2A, GRIN3A PIK3CD 2262/4885CYP2D6 3722/4885SMN1; SMN2 860/4885

“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.