SCHEMBL20495191

SCHEMBL20495191

O=C(O)N[C@H]1C[C@@H](CO)N(Cc2ccccc2)C1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HDAC11 Q96DB2 2/20 0.47
▸ SIGMAR1 Q99720 2/20 0.41
▸ MAPT P10636 1/20 0.40
▸ DRD4 P21917 1/20 0.40
▸ OPRK1 P41145 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ GBA1 P04062 1/20 0.39

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
SCHEMBL15595187 0.89 OGA (0.46) HDAC11SIGMAR1MAPT
SCHEMBL18922700 0.89 OGA (0.46) HDAC11SIGMAR1MAPT
SCHEMBL20494615 0.88 SIGMAR1 (0.40) SIGMAR1MAPTDRD4OPRK1L3MBTL1
SCHEMBL3398912 0.85 CTSL (0.54) HDAC11
SCHEMBL19875824 0.85 SIGMAR1 (0.52) SIGMAR1L3MBTL1
SCHEMBL21166309 0.83 KMT2A (0.59) HDAC11SIGMAR1MAPTL3MBTL1
SCHEMBL16978164 0.81 BRD4 (0.47) MAPT
SCHEMBL23326734 0.78 HDAC11 (0.45) HDAC11SIGMAR1MAPT
SCHEMBL20495207 0.78 HDAC11 (0.45) HDAC11SIGMAR1MAPT
SCHEMBL20495223 0.78 HDAC11 (0.45) HDAC11SIGMAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11993571-B2 Indole derivatives as efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2024-05-28 — — US disclosed
US-20210094912-A1 INDOLE DERIVATIVES AS EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERISTY OF NEW JERSEY (US) 2021-04-01 — — US disclosed
US-10774064-B2 Potassium channel modulators CADENT THERAPEUTICS, INC. (US) 2020-09-15 — — US disclosed
WO-2018165611-A1 INDOLE DERIVATIVES AS EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2018-09-13 — — 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 (3 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-10774064-B2 Potassium channel modulators KCNJ11, KCNJ2, KCNJ1 HDAC11 780/4885SIGMAR1 1660/4885MAPT 2009/4885
US-20210094912-A1 INDOLE DERIVATIVES AS EFFLUX PUMP INHIBITORS ABCB11, ABCB1, ABCG2 HDAC11 1650/4885SIGMAR1 453/4885MAPT 3634/4885
US-11993571-B2 Indole derivatives as efflux pump inhibitors ABCB11, ABCB1, ABCG2 HDAC11 1650/4885SIGMAR1 453/4885MAPT 3634/4885

“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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