SCHEMBL30993539

SCHEMBL30993539

CN(C)c1cc(Br)cc2c(C(=O)O)c[nH]c12

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.36
▸ CSNK2A2 P19784 4/20 0.35
▸ CSNK2B P67870 4/20 0.35
▸ CSNK2A1 P68400 4/20 0.35
▸ PRKAG1 P54619 2/20 0.35
▸ PRKAA1 Q13131 2/20 0.35
▸ PRKAB1 Q9Y478 2/20 0.35
▸ PRKAB2 O43741 1/20 0.35
▸ PRKAA2 P54646 1/20 0.35
▸ PRKAG3 Q9UGI9 1/20 0.35
▸ PRKAG2 Q9UGJ0 1/20 0.35
▸ AKR1C4 P17516 1/20 0.35
▸ AKR1C3 P42330 1/20 0.35
▸ AKR1C2 P52895 1/20 0.35
▸ AKR1C1 Q04828 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ F7 P08709 1/20 0.34

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
SCHEMBL31023108 0.85 NR4A2 (0.55) NR4A2HSD17B10ALDH1A1KDM4EHPGD
SCHEMBL30993555 0.85 CREBBP (0.42) NR4A2
SCHEMBL22462503 0.78 AKR1C4 (0.48) NR4A2CSNK2A2CSNK2BCSNK2A1PRKAG1
SCHEMBL30993503 0.76 — —
SCHEMBL31022882 0.75 GABRA1 (0.42) NR4A2CSNK2A2CSNK2BCSNK2A1PRKAG1
SCHEMBL3196612 0.69 KDM4E (0.48) AKR1C3AKR1C2HSD17B10ALDH1A1KDM4E
SCHEMBL20605026 0.69 MYC (0.47) CSNK2A2CSNK2BCSNK2A1PRKAG1PRKAA1
SCHEMBL9288270 0.69 AKR1C3 (0.39) NR4A2PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL19328315 0.68 AKR1C4 (0.38) NR4A2PRKAG1PRKAA1PRKAB1PRKAB2
Lithium SCHEMBL17802201 0.68 AKR1C3 (0.38) NR4A2PRKAG1PRKAA1PRKAB1PRKAB2

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
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
WO-2024130095-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-06-20 — — WO disclosed
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