SCHEMBL30156757

SCHEMBL30156757

CN(C)CCOc1cc(Br)c2c(c1)CCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.45
▸ NR1H2 P55055 1/20 0.44
▸ ABHD6 Q9BV23 2/20 0.42
▸ MGLL Q99685 1/20 0.42
▸ GPR119 Q8TDV5 7/20 0.41
▸ MAPT P10636 3/20 0.38
▸ ADORA1 P30542 1/20 0.38
▸ HSP90B1 P14625 1/20 0.37
▸ TRAP1 Q12931 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ MMP1 P03956 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP13 P45452 1/20 0.37
▸ ADAM17 P78536 1/20 0.37
▸ PDE10A Q9Y233 1/20 0.37
▸ MTHFD2 P13995 1/20 0.37

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
SCHEMBL24913916 1.00 ESR2 (0.45) ESR2NR1H2ABHD6MGLLGPR119
SCHEMBL31013971 0.92 MGLL (0.48) ESR2NR1H2ABHD6MGLLGPR119
SCHEMBL30156709 0.88 ESR2 (0.46) ESR2NR1H2ABHD6GPR119MAPT
SCHEMBL17463409 0.88 ESR2 (0.46) ESR2NR1H2GPR119MAPTADORA1
SCHEMBL30789204 0.88 ESR2 (0.46) ESR2NR1H2ABHD6GPR119MAPT
SCHEMBL31013952 0.86 ESR2 (0.43) ESR2NR1H2ABHD6MGLLGPR119
SCHEMBL31014030 0.86 ESR2 (0.43) ESR2NR1H2ABHD6MGLLGPR119
SCHEMBL31014042 0.85 ESR2 (0.43) ESR2NR1H2ABHD6MGLLGPR119
SCHEMBL31013916 0.85 MGLL (0.45) ESR2NR1H2ABHD6MGLLGPR119
SCHEMBL31013875 0.84 ESR2 (0.52) ESR2NR1H2ABHD6MAPTADORA1

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-20240293392-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2024-09-05 — — US disclosed
WO-2023002165-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2023-01-26 — — 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 (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-20240293392-A1 INHIBITOR COMPOUNDS MSH2, PMS2, MSH6 ESR2 568/4885NR1H2 2027/4885ABHD6 4782/4885

“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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