SCHEMBL29451432

SCHEMBL29451432

Cc1cc(N2CCOCC2)ccc1NC(=O)Cn1ncc(Cl)c(Cl)c1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 9/20 0.58
▸ MITF O75030 7/20 0.58
▸ HTT P42858 6/20 0.58
▸ NPC1 O15118 5/20 0.58
▸ NPSR1 Q6W5P4 4/20 0.58
▸ PAX8 Q06710 6/20 0.55
▸ L3MBTL1 Q9Y468 6/20 0.54
▸ ALDH1A1 P00352 6/20 0.54
▸ MAPT P10636 5/20 0.54
▸ LMNA P02545 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ POLB P06746 2/20 0.54
▸ RECQL P46063 2/20 0.54
▸ MCL1 Q07820 2/20 0.54
▸ PRMT5 O14744 7/20 0.51
▸ WDR77 Q9BQA1 7/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ S1PR4 O95977 3/20 0.51
▸ OPRK1 P41145 1/20 0.51

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
SCHEMBL29451781 0.88 RAB9A (0.58) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29451793 0.75 RAB9A (0.61) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29451315 0.73 RAB9A (0.61) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29451353 0.73 PRMT5 (0.84) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29452154 0.71 MITF (1.00) RAB9AMITFHTTNPC1PAX8
SCHEMBL29451943 0.71 RAB9A (0.53) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29451608 0.70 RAB9A (0.76) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29452083 0.70 PRMT5 (0.74) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29451409 0.70 PRMT5 (0.68) RAB9AMITFHTTNPC1NPSR1
SCHEMBL29452248 0.68 ALDH1A1 (0.64) RAB9AMITFHTTNPC1NPSR1

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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