SCHEMBL23924075

SCHEMBL23924075

O=C(O)N1CC(Oc2cccc3cnccc23)C(c2ccccc2)C1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 2/20 0.44
GRIN2B Q13224 2/20 0.44
HCRTR1 O43613 2/20 0.43
HCRTR2 O43614 2/20 0.43
KCNA3 P22001 1/20 0.40
NPC1 O15118 1/20 0.37
NR2F2 P24468 1/20 0.37
CHRM1 P11229 2/20 0.36
P2RX7 Q99572 3/20 0.36
ROCK2 O75116 2/20 0.36
KDM4E B2RXH2 2/20 0.35
MAPKAPK2 P49137 1/20 0.35
TRPV1 Q8NER1 2/20 0.35
NSD2 O96028 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL23924073 1.00 GRIN1 (0.44) GRIN1GRIN2BHCRTR1HCRTR2KCNA3
SCHEMBL23924097 1.00 GRIN1 (0.44) GRIN1GRIN2BHCRTR1HCRTR2KCNA3
SCHEMBL28932927 0.87 RORC (0.46) GRIN1GRIN2BHCRTR1HCRTR2P2RX7
SCHEMBL23924114 0.82 KCNA3 (0.46) GRIN1GRIN2BHCRTR1HCRTR2KCNA3
SCHEMBL23924496 0.81 TRPV1 (0.45) KDM4ETRPV1NSD2ALDH1A1LMNA
SCHEMBL23924495 0.81 TRPV1 (0.45) KDM4ETRPV1NSD2ALDH1A1LMNA
SCHEMBL23924256 0.79 KMT2A (0.48) NPC1NR2F2KDM4ETRPV1NSD2
SCHEMBL23924009 0.79 KMT2A (0.48) NPC1NR2F2KDM4ETRPV1NSD2
SCHEMBL23924265 0.77 ALDH1A1 (0.41) HCRTR1HCRTR2CHRM1P2RX7ROCK2
SCHEMBL23951474 0.76 KCNA3 (0.44) GRIN1GRIN2BHCRTR1HCRTR2KCNA3

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-20220213061-A9 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 TES PHARMA S.R.L. (IT) 2022-07-07 US disclosed
US-20210323942-A1 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 TES PHARMA S R L (IT) 2021-10-21 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-20220213061-A9 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 NR2E3, NR2F2, NR2C2 GRIN1 81/4885GRIN2B 80/4885HCRTR1 1936/4885
US-20210323942-A1 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 NR2E3, NR2F2, NR2C2 GRIN1 81/4885GRIN2B 80/4885HCRTR1 1936/4885

“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.