SCHEMBL31022995

SCHEMBL31022995

COC(=O)c1c[nH]c2c(Br)cc(Cl)cc12

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 11/20 0.57
▸ CREBBP Q92793 1/20 0.44
▸ CHEK1 O14757 1/20 0.42
▸ SERPINH1 P50454 1/20 0.42
▸ MAP2K1 Q02750 1/20 0.41
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MTNR1A P48039 1/20 0.40
▸ MTNR1B P49286 1/20 0.40
▸ AXL P30530 1/20 0.39
▸ ABL1 P00519 1/20 0.39

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
SCHEMBL23622948 0.83 F7 (0.51) NR4A2
SCHEMBL30993716 0.82 CREBBP (0.41) NR4A2CREBBPKMT2AMTNR1AMTNR1B
SCHEMBL19644378 0.79 NR4A2 (0.61) NR4A2CREBBPCHEK1MAP2K1AXL
SCHEMBL20604733 0.78 NR4A2 (0.46) NR4A2CREBBPMAP2K1
SCHEMBL17113293 0.76 NR4A2 (0.70) NR4A2CREBBPMAP2K1AXL
SCHEMBL1078500 0.75 NR4A2 (0.51) NR4A2CREBBPCHEK1SERPINH1MEN1
SCHEMBL19644386 0.73 NR4A2 (0.54) NR4A2CREBBPMAP2K1AXL
SCHEMBL15300951 0.73 NR4A2 (0.61) NR4A2CREBBP
SCHEMBL4242189 0.73 NR4A2 (1.00) NR4A2CREBBP
SCHEMBL610371 0.73 ABL1 (0.64) NR4A2CHEK1MEN1KMT2AABL1

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
WO-2024130095-A9 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-08-02 — — WO disclosed
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