SCHEMBL29451624

SCHEMBL29451624

CCOC(=O)Cn1ncc(Cl)c(CNC)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ NPSR1 Q6W5P4 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ S1PR4 O95977 2/20 0.46
▸ S1PR1 P21453 2/20 0.46
▸ PAX8 Q06710 1/20 0.46
▸ NLRP3 Q96P20 1/20 0.45
▸ BRD4 O60885 1/20 0.41
▸ HTT P42858 3/20 0.41
▸ MITF O75030 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ CYP2C19 P33261 3/20 0.40
▸ CYP1A2 P05177 2/20 0.40
▸ CYP2C9 P11712 2/20 0.40

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
SCHEMBL29451899 0.85 MEN1 (0.47) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29451976 0.84 MEN1 (0.46) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29451496 0.82 MEN1 (0.46) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29451395 0.82 MEN1 (0.46) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29451328 0.81 MEN1 (0.51) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL2895158 0.81 ALDH1A1 (0.61) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29451769 0.81 MEN1 (0.44) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29452222 0.78 MEN1 (0.48) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL29452287 0.78 MEN1 (0.46) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2
SCHEMBL13024307 0.77 SMN1; SMN2 (0.50) ALDH1A1NPSR1MEN1KMT2ASMN1; SMN2

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-2022032144-A1 SUBSTRATE ADAPTOR INHIBITORS OF PRMT5 AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2022-02-10 — — WO disclosed
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