SCHEMBL23651268

SCHEMBL23651268

O=C(NCCOCCOCCCCCCCl)OCCOCCOCCNC(=O)c1ccc2c(c1)C1(OC2O)c2ccc(N3CCC3)cc2Oc2cc(N3CCC3)ccc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.35
▸ TLR2 O60603 2/20 0.32
▸ DRD4 P21917 5/20 0.32
▸ DRD2 P14416 5/20 0.32
▸ DRD3 P35462 3/20 0.32
▸ ADRA1A P35348 2/20 0.32
▸ USP2 O75604 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ SLC2A1 P11166 1/20 0.31
▸ NT5E P21589 1/20 0.30
▸ KLKB1 P03952 1/20 0.30
▸ F10 P00742 2/20 0.30
▸ MAPT P10636 2/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ PMP22 Q01453 1/20 0.30

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
SCHEMBL23651247 0.86 NT5E (0.39) OPRM1TLR2DRD4DRD2DRD3
SCHEMBL31398727 0.86 NT5E (0.39) OPRM1TLR2DRD4DRD2DRD3
SCHEMBL18526322 0.81 NT5E (0.41) OPRM1TLR2DRD4DRD2DRD3
SCHEMBL24942516 0.79 OPRM1 (0.37) OPRM1TLR2DRD4DRD2DRD3
SCHEMBL23917997 0.78 NT5E (0.33) NT5E
SCHEMBL18526237 0.77 OPRM1 (0.35) OPRM1TLR2DRD4DRD2DRD3
SCHEMBL18493212 0.77 OPRM1 (0.34) OPRM1TLR2USP2ALDH1A1SMN1; SMN2
SCHEMBL30112567 0.75 NT5E (0.40) OPRM1SMN1; SMN2NT5EF10CYP3A4
SCHEMBL24942508 0.75 NT5E (0.40) OPRM1SMN1; SMN2NT5EF10CYP3A4
SCHEMBL31398730 0.74 ALDH1A1 (0.34) ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11067566-B2 Photochromic xanthene fluorophores and their utility live-cell beyond the diffraction limit HOWARD HUGHES MEDICAL INSTITUTE (US) 2021-07-20 — — 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-11067566-B2 Photochromic xanthene fluorophores and their utility live-cell beyond the diffraction limit XPA, ANXA5, KIF20A OPRM1 4866/4885TLR2 1481/4885DRD4 2207/4885

“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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