SCHEMBL30993446

SCHEMBL30993446

CC1(C)OB(c2ccc(N)c(N)c2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPL P06858 13/20 0.50
LIPG Q9Y5X9 13/20 0.50
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA9 Q16790 3/20 0.46
CA12 O43570 1/20 0.46
CA3 P07451 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA14 Q9ULX7 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
F11 P03951 2/20 0.45
F2 P00734 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
ESR2 Q92731 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL189992 1.00 LPL (0.50) LPLLIPGCA1CA2CA9
SCHEMBL3690091 0.86 LPL (0.46) LPLLIPGCA1CA2CA9
SCHEMBL16105038 0.85 LPL (0.44) LPLLIPGCA1CA2CA9
SCHEMBL1290153 0.85 LPL (0.51) LPLLIPGCA1CA2CA9
SCHEMBL4813256 0.85 CA1 (0.45) LPLLIPGCA1CA2CA9
Hydrochloric Acid SCHEMBL31547133 0.85 LPL (0.44) LPLLIPGCA1CA2CA9
SCHEMBL24252766 0.84 LPL (0.47) LPLLIPGCA1CA2CA9
SCHEMBL60127 0.84 LPL (0.47) LPLLIPGCA1CA2CA9
SCHEMBL59080 0.82 LPL (0.53) LPLLIPGCA1CA2CA9
SCHEMBL20887537 0.82 LPL (0.46) LPLLIPGCA1CA2CA9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024130095-A9 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-08-02 WO disclosed
WO-2024130095-A1 COMPOUNDS AND COMPOSITIONS AS CBP/P300 DEGRADERS AND USES THEREOF REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-06-20 WO disclosed