SCHEMBL29451302

SCHEMBL29451302

CC(=O)c1c(Cl)cnn(CC(=O)O)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MITF O75030 9/20 0.50
▸ ALDH1A1 P00352 9/20 0.50
▸ HTT P42858 8/20 0.50
▸ NPC1 O15118 7/20 0.50
▸ SMN1; SMN2 Q16637 6/20 0.50
▸ RAB9A P51151 9/20 0.45
▸ LMNA P02545 4/20 0.45
▸ GAA P10253 1/20 0.45
▸ MAPT P10636 6/20 0.44
▸ S1PR4 O95977 5/20 0.44
▸ S1PR1 P21453 5/20 0.44
▸ TP53 P04637 2/20 0.44
▸ POLB P06746 4/20 0.44
▸ NPSR1 Q6W5P4 3/20 0.44
▸ KMO O15229 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ RECQL P46063 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ MCL1 Q07820 1/20 0.41

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
SCHEMBL29452222 0.83 MEN1 (0.48) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL29451310 0.80 ALDH1A1 (0.53) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL2888078 0.80 HTT (0.69) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL15484968 0.76 ALDH1A1 (0.51) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL23122130 0.76 NPC1 (0.46) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL29451307 0.75 ALDH1A1 (0.48) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL29102671 0.75 NPBWR1 (0.68) MITFALDH1A1HTTSMN1; SMN2RAB9A
SCHEMBL29451571 0.74 HTT (0.47) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL29451575 0.74 ALDH1A1 (0.47) MITFALDH1A1HTTNPC1SMN1; SMN2
SCHEMBL29451930 0.73 ALDH1A1 (0.46) MITFALDH1A1HTTNPC1SMN1; 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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