SCHEMBL26505087

SCHEMBL26505087

CC(C)(C)c1ccc(C(=O)[O-])c(-c2c3ccc(=[N+]4CCC4)cc-3oc3cc(N4CCC4)ccc23)c1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.30
▸ P2RY6 Q15077 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
SCHEMBL26505092 0.97 ABCB1 (0.30) ABCB1P2RY6
SCHEMBL20362560 0.86 ABCB1 (0.40) ABCB1P2RY6
SCHEMBL26505115 0.83 ABCB1 (0.40) ABCB1P2RY6
SCHEMBL20363385 0.80 PTGER4 (0.37) ABCB1
SCHEMBL20281372 0.78 ABCB1 (0.40) ABCB1
SCHEMBL19846795 0.78 ABCB1 (0.53) ABCB1
SCHEMBL26505165 0.77 — —
SCHEMBL19635154 0.77 ABCB1 (0.33) ABCB1
SCHEMBL24012466 0.77 PTGER4 (0.37) —
SCHEMBL19635146 0.76 ABCB1 (0.33) ABCB1

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-11787946-B2 Deuterated fluorophores HOWARD HUGHES MEDICAL INSTITUTE (US) 2023-10-17 — — 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-11787946-B2 Deuterated fluorophores HDHD5, DRD4, ARF4 ABCB1 1409/4885P2RY6 3469/4885

“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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