SCHEMBL31014016

SCHEMBL31014016

CC(C)(C)OC(=O)Oc1cc(Br)c2c(c1)CCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 2/20 0.49
▸ NR1H2 P55055 1/20 0.48
▸ ADORA1 P30542 2/20 0.41
▸ MAPT P10636 3/20 0.40
▸ ABHD6 Q9BV23 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ MKNK1 Q9BUB5 3/20 0.37
▸ UCHL1 P09936 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.36
▸ ESR1 P03372 1/20 0.36
▸ LMNA P02545 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
SCHEMBL31013875 0.89 ESR2 (0.52) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL17469262 0.83 ESR2 (0.46) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL30156710 0.83 ESR2 (0.46) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL17462460 0.83 ESR2 (0.53) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL15503050 0.83 ESR2 (0.63) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL30156741 0.83 ESR2 (0.63) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL30789204 0.82 ESR2 (0.46) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL17463409 0.82 ESR2 (0.46) ESR2NR1H2ADORA1MAPTKDM4E
SCHEMBL30156709 0.82 ESR2 (0.46) ESR2NR1H2ADORA1MAPTABHD6
SCHEMBL25294751 0.82 ESR2 (0.55) ESR2NR1H2ADORA1MAPTABHD6

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
EP-4651955-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2025-11-26 — — EP disclosed
WO-2024153947-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2024-07-25 — — WO disclosed
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