SCHEMBL22260347

SCHEMBL22260347

C=C(CCCN)[C@@](C)(O)C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.32
GABRR3 A8MPY1 1/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
HDAC3 O15379 1/20 0.32
GABBR2 O75899 1/20 0.32
LMNA P02545 1/20 0.32
THRB P10828 1/20 0.32
GABRA1 P14867 1/20 0.32
TSHR P16473 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRR1 P24046 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRR2 P28476 1/20 0.32
SLC6A1 P30531 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32

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
SCHEMBL20716155 0.78 CYP1A2 (0.36) CYP1A2GABRR3GABRPGABRDHDAC3
SCHEMBL25975231 0.71 GABRR3 (0.31) CYP1A2GABRR3GABRPGABRDHDAC3
SCHEMBL21081410 0.70 PAOX (0.44) LMNATHRBTSHRBLMKMT2A
SCHEMBL921645 0.64
Chloromethane SCHEMBL1802829 0.64 LMNA (0.48) CYP1A2GABRR3GABRPGABRDHDAC3
Chloromethane SCHEMBL18426112 0.64 CYP1A2 (0.42) CYP1A2GABRR3GABRPGABRDHDAC3
SCHEMBL3720306 0.63 LMNA (0.45) CYP1A2GABRR3GABRPGABRDHDAC3
SCHEMBL19387328 0.62
Chloromethane SCHEMBL9186830 0.61 NFKB1 (0.55) LMNATSHRBLMKMT2A
Ammonia Solution, Strong SCHEMBL549097 0.61 LMNA (0.43) CYP1A2GABRR3GABRPGABRDHDAC3

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-20200231620-A1 TECHNOLOGIES FOR OLIGONUCLEOTIDE PREPARATION WAVE LIFE SCIENCES LTD. (SG) 2020-07-23 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-20200231620-A1 TECHNOLOGIES FOR OLIGONUCLEOTIDE PREPARATION POLRMT, DCLRE1B, RNGTT CYP1A2 4658/4885GABRR3 2898/4885GABRP 4518/4885

“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.