SCHEMBL22672748

SCHEMBL22672748

CCCCCC(C)N1CCN(C(=O)C(C)(C)OCC)CC1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.34
▸ HRH2 P25021 1/20 0.33
▸ HRH1 P35367 1/20 0.33
▸ CHRM3 P20309 1/20 0.33
▸ CA1 P00915 2/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HRH3 Q9Y5N1 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ KDM2B Q8NHM5 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ GNAI3 P08754 1/20 0.30
▸ GNAI1 P63096 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
SCHEMBL23847255 0.86 ALDH1A1 (0.34) ALDH1A1HRH2HRH1HRH3CA2
SCHEMBL11571795 0.77 ALDH1A1 (0.45) ALDH1A1HRH2HRH1L3MBTL1KDM4E
SCHEMBL4383363 0.77 USP2 (0.42) ALDH1A1HRH3MEN1KMT2AL3MBTL1
SCHEMBL21733078 0.76 CHRM3 (0.33) ALDH1A1HRH2HRH1CHRM3CA1
SCHEMBL23490206 0.74 SMPD1 (0.31) —
SCHEMBL9070252 0.73 OPRM1 (0.44) CA1TP53MEN1KMT2AKDM2B
SCHEMBL20160499 0.73 USP2 (0.44) ALDH1A1HRH3MEN1KMT2AL3MBTL1
SCHEMBL21348984 0.73 HTR1A (0.43) ALDH1A1KDM4E
SCHEMBL881484 0.73 GNAI3 (0.54) MEN1KMT2AL3MBTL1GNAI3GNAI1
SCHEMBL21374418 0.72 SMPD1 (0.32) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11384105-B2 Processes for preparing oligomers SAREPTA THERAPEUTICS, INC. (US) 2022-07-12 — — US disclosed
US-20210198296-A1 PROCESSES FOR PREPARING OLIGOMERS SAREPTA THERAPEUTICS, INC. (US) 2021-07-01 — — US disclosed
US-20200362339-A1 PROCESSES FOR PREPARING PHOSPHORODIAMIDATE MORPHOLINO OLIGOMERS VIA FAST-FLOW SYNTHESIS MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2020-11-19 — — 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-20210198296-A1 PROCESSES FOR PREPARING OLIGOMERS PCBP1, RNGTT, PHAX ALDH1A1 4252/4885HRH2 4882/4885HRH1 4859/4885
US-11384105-B2 Processes for preparing oligomers NOP2, RNGTT, PCBP1 ALDH1A1 4482/4885HRH2 4885/4885HRH1 4880/4885

“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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