SCHEMBL23326764

SCHEMBL23326764

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

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.43
▸ SIGMAR1 Q99720 3/20 0.43
▸ HDAC11 Q96DB2 1/20 0.42
▸ BTK Q06187 1/20 0.42
▸ CXCR4 P61073 1/20 0.40
▸ GBA1 P04062 1/20 0.39
▸ DRD2 P14416 2/20 0.39
▸ DRD1 P21728 2/20 0.39
▸ DRD3 P35462 2/20 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
SCHEMBL20495207 0.84 HDAC11 (0.45) MAPTSIGMAR1HDAC11BTK
SCHEMBL20494367 0.84 HDAC11 (0.45) MAPTSIGMAR1HDAC11BTK
SCHEMBL20495223 0.84 HDAC11 (0.45) MAPTSIGMAR1HDAC11BTK
SCHEMBL23326734 0.84 HDAC11 (0.45) MAPTSIGMAR1HDAC11BTK
SCHEMBL14256288 0.82 CCR3 (0.45) MAPTSIGMAR1HDAC11GBA1
SCHEMBL20494596 0.81 MAPT (0.43) MAPTSIGMAR1HDAC11BTKGBA1
SCHEMBL9697554 0.80 SIGMAR1 (0.43) MAPTSIGMAR1HDAC11GBA1DRD2
SCHEMBL9696934 0.80 SIGMAR1 (0.43) MAPTSIGMAR1HDAC11GBA1DRD2
SCHEMBL23326928 0.79 HDAC11 (0.41) MAPTSIGMAR1HDAC11BTK
SCHEMBL25339102 0.79 NR1H2 (0.50) SIGMAR1HDAC11BTK

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-11938114-B2 Bacterial efflux pump inhibitors RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2024-03-26 — — US disclosed
US-20210137881-A1 BACTERIAL EFFLUX PUMP INHIBITORS RUTGERS, THE STATE UNIVERISTY OF NEW JERSEY (US) 2021-05-13 — — 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-11938114-B2 Bacterial efflux pump inhibitors ABCB11, ABCB1, SLC47A1 MAPT 4395/4885SIGMAR1 1147/4885HDAC11 2222/4885
US-20210137881-A1 BACTERIAL EFFLUX PUMP INHIBITORS ABCB11, ABCB1, SLC47A1 MAPT 4395/4885SIGMAR1 1147/4885HDAC11 2222/4885

“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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