SCHEMBL25955360

SCHEMBL25955360

CC1(C)OB(c2cccnc2Oc2ccc([SH](F)(F)(F)F)cc2)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 7/20 0.40
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL31395494 0.85 LIPE (0.42) LIPEMEN1KMT2A
SCHEMBL1360468 0.84 TDP1 (0.44) LIPEMEN1KMT2AALDH1A1TDP1
SCHEMBL25426624 0.83 LIPE (0.55) LIPEALDH1A1MAPTATM
SCHEMBL580807 0.83 MEN1 (0.45) LIPEMEN1KMT2AALDH1A1MAPT
SCHEMBL25976343 0.82 LIPE (0.40) LIPEMEN1KMT2AMAPT
SCHEMBL25340238 0.82 LIPE (0.40) LIPEMEN1KMT2AALDH1A1MAPT
SCHEMBL1484864 0.76 APLNR (0.38) LIPETDP1
SCHEMBL30292561 0.76 APLNR (0.38) LIPETDP1
SCHEMBL25955371 0.76 EGFR (0.35) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL22052722 0.76 LIPE (0.36) LIPEMEN1KMT2A

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-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed