SCHEMBL23924265

SCHEMBL23924265

O=C(c1cccc2cnccc12)[C@H]1CN(C(=O)O)C[C@@H]1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
CCR5 P51681 2/20 0.41
PREP P48147 2/20 0.39
DPP7 Q9UHL4 1/20 0.39
ROCK2 O75116 2/20 0.38
CHRM1 P11229 2/20 0.37
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPKAPK2 P49137 1/20 0.36
P2RX7 Q99572 1/20 0.36
TRPV1 Q8NER1 2/20 0.35
CNR1 P21554 1/20 0.35
CNR2 P34972 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
SCHEMBL23924266 1.00 ALDH1A1 (0.41) ALDH1A1LMNACCR5PREPDPP7
SCHEMBL23951504 0.86 RORC (0.46) ALDH1A1KDM4EP2RX7
SCHEMBL28932959 0.86 RORC (0.46) ALDH1A1KDM4EP2RX7
SCHEMBL23924365 0.83 RORC (0.51) ROCK2P2RX7
SCHEMBL29900609 0.83 RORC (0.51) ROCK2P2RX7
SCHEMBL23924367 0.83 RORC (0.51) ROCK2P2RX7
SCHEMBL23951506 0.83 RORC (0.51) ROCK2P2RX7
SCHEMBL23924282 0.82 TRPV1 (0.47) ALDH1A1LMNAROCK2KDM4ETRPV1
SCHEMBL23924493 0.82 TRPV1 (0.47) ALDH1A1LMNAROCK2KDM4ETRPV1
SCHEMBL23924118 0.82 TRPV1 (0.47) ALDH1A1LMNAROCK2KDM4ETRPV1

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 ALDH1A1 2328/4885LMNA 4183/4885CCR5 4065/4885
US-20210323942-A1 HETEROCYCLIC COMPOUNDS FOR MODULATING NR2F6 NR2E3, NR2F2, NR2C2 ALDH1A1 2328/4885LMNA 4183/4885CCR5 4065/4885

“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.