SCHEMBL17866040

SCHEMBL17866040

[CH2][C@H]1C[C@@H](n2ccc3c(NC)ncnc32)C[C@@H]1O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 7/20 0.45
▸ WDR77 Q9BQA1 7/20 0.45
▸ UBA6 A0AVT1 5/20 0.41
▸ NAE1 Q13564 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ GRK5 P34947 1/20 0.40
▸ CSNK1A1 P48729 1/20 0.40
▸ NEDD8 Q15843 1/20 0.40
▸ UBA3 Q8TBC4 1/20 0.40
▸ SAE1 Q9UBE0 1/20 0.40
▸ UBA2 Q9UBT2 1/20 0.40
▸ PIP4K2A P48426 1/20 0.40
▸ YTHDC1 Q96MU7 1/20 0.39
▸ ADORA3 P0DMS8 3/20 0.37
▸ ADORA1 P30542 1/20 0.37

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
SCHEMBL17866020 0.84 UBA6 (0.43) PRMT5WDR77UBA6
SCHEMBL17866043 0.83 PRMT5 (0.42) PRMT5WDR77UBA6NAE1CA2
SCHEMBL17866056 0.80 TP53 (0.47) PRMT5WDR77
SCHEMBL17875203 0.80 PRMT5 (0.47) PRMT5WDR77NAE1CA2GRK5
SCHEMBL17866032 0.80 METTL3 (0.49) PRMT5WDR77UBA6NAE1CA2
SCHEMBL12983619 0.80 POLB (0.43) PRMT5WDR77UBA6NAE1CA2
SCHEMBL17866063 0.79 METTL3 (0.37) PRMT5WDR77UBA6NAE1CA2
SCHEMBL17865973 0.79 UBA6 (0.42) PRMT5WDR77UBA6NAE1CA2
SCHEMBL17866045 0.79 LMNA (0.43) UBA6NAE1CA2GRK5CSNK1A1
SCHEMBL5456441 0.79 KDM4E (0.52) UBA6PIP4K2AADORA3ADORA1

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
EP-2402334-B1 Inhibitors of E1 Activating Enzymes MILLENNIUM PHARM INC (US) 2016-06-29 — — EP claimed
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