SCHEMBL30908540

SCHEMBL30908540

CC(=O)OCC(C)(C)c1ccc(Br)cn1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ CYP2C19 P33261 2/20 0.35
▸ RAB9A P51151 6/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ TSHR P16473 3/20 0.35
▸ DGAT1 O75907 1/20 0.35
▸ MAPT P10636 3/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ CCR9 P51686 1/20 0.33

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
SCHEMBL1820710 0.82 GBA1 (0.37) ALDH1A1KDM4ECYP2C19RAB9ANPC1
SCHEMBL30908504 0.81 L3MBTL1 (0.46) ALDH1A1KDM4ECYP2C19MAPTCYP2C9
SCHEMBL15877470 0.79 CYP2C19 (0.38) ALDH1A1KDM4ECYP2C19RAB9ANPC1
SCHEMBL1817853 0.75 GBA1 (0.39) ALDH1A1KDM4ERAB9ANPC1TSHR
SCHEMBL30908459 0.75 GBA1 (0.39) ALDH1A1KDM4ERAB9ANPC1TSHR
SCHEMBL1002566 0.73 CYP2C19 (0.48) ALDH1A1KDM4ECYP2C19RAB9ANPC1
SCHEMBL15118626 0.73 LMNA (0.41) ALDH1A1KDM4ECYP2C19RAB9ANPC1
SCHEMBL14466870 0.72 LMNA (0.40) ALDH1A1KDM4ECYP2C19RAB9ANPC1
SCHEMBL1063890 0.71 ALDH1A1 (0.42) ALDH1A1KDM4ERAB9ANPC1TSHR
SCHEMBL29630882 0.71 ALDH1A1 (0.42) ALDH1A1KDM4ERAB9ANPC1TSHR

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-2024074611-A1 PRMT5 INHIBITORS Ryvu Therapeutics S.A. (PL) 2024-04-11 — — WO disclosed
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