SCHEMBL31370787

SCHEMBL31370787

CC(C)(C)[Si](C)(C)OCCn1cc(Br)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DUT P33316 2/20 0.38
▸ POLB P06746 2/20 0.36
▸ L3MBTL1 Q9Y468 3/20 0.36
▸ CNR1 P21554 2/20 0.36
▸ CNR2 P34972 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ GSK3B P49841 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ PTPN7 P35236 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ NR2F2 P24468 1/20 0.35

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
SCHEMBL18616173 0.83 MCL1 (0.40) DUTL3MBTL1CNR1CNR2MAPT
SCHEMBL2262948 0.83 DUT (0.42) DUTMAPT
SCHEMBL20604606 0.82 L3MBTL1 (0.36) DUTL3MBTL1CNR1CNR2MAPT
SCHEMBL30647201 0.81 POLB (0.59) POLBL3MBTL1MAPTTDP1ALDH1A1
SCHEMBL5823744 0.81 POLB (0.59) POLBL3MBTL1MAPTTDP1ALDH1A1
SCHEMBL1779408 0.81 MAPT (0.58) POLBL3MBTL1MAPTTSHRTDP1
SCHEMBL16145665 0.78 POLB (0.52) POLBCNR1CNR2ALDH1A1
SCHEMBL16145928 0.78 MCL1 (0.40) DUTPOLB
SCHEMBL14522478 0.77 ICMT (0.58) —
SCHEMBL16146216 0.76 MCL1 (0.51) —

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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 — — 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-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 DUT 3936/4885POLB 4547/4885L3MBTL1 1869/4885

“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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