SCHEMBL29451810

SCHEMBL29451810

O=C(O)Cn1ncc(Cl)c(C2CC2)c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MITF O75030 9/20 0.47
▸ RAB9A P51151 9/20 0.47
▸ NPC1 O15118 6/20 0.47
▸ HTT P42858 10/20 0.45
▸ ALDH1A1 P00352 9/20 0.45
▸ SMN1; SMN2 Q16637 7/20 0.45
▸ MAPT P10636 7/20 0.45
▸ LMNA P02545 5/20 0.45
▸ RECQL P46063 2/20 0.45
▸ MDM2 Q00987 2/20 0.45
▸ PAX8 Q06710 3/20 0.43
▸ S1PR4 O95977 5/20 0.43
▸ S1PR1 P21453 5/20 0.43
▸ TP53 P04637 2/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ KMO O15229 1/20 0.41
▸ POLB P06746 4/20 0.41
▸ NPSR1 Q6W5P4 3/20 0.39
▸ OPRD1 P41143 2/20 0.39
▸ OPRK1 P41145 2/20 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
SCHEMBL29452287 0.83 MEN1 (0.46) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL29452234 0.82 KDM4E (0.37) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL2888078 0.77 HTT (0.69) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL17582539 0.74 NPBWR1 (0.50) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL29451310 0.74 ALDH1A1 (0.53) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL29451307 0.73 ALDH1A1 (0.48) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL29451302 0.72 MITF (0.50) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL29451467 0.71 HTT (0.46) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL29451786 0.71 HTT (0.46) MITFRAB9ANPC1HTTALDH1A1
SCHEMBL29451930 0.71 ALDH1A1 (0.46) MITFRAB9ANPC1HTTALDH1A1

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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