SCHEMBL30219759

SCHEMBL30219759

CCC(NCCc1ccc(C(F)(F)F)c(Cl)c1)c1cccc(N)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 4/20 0.38
▸ DAO P14920 1/20 0.36
▸ HCRTR1 O43613 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34
▸ KCNH2 Q12809 4/20 0.33
▸ CYP3A4 P08684 3/20 0.33
▸ CYP2D6 P10635 3/20 0.33
▸ SLC6A2 P23975 3/20 0.33
▸ SLC6A4 P31645 3/20 0.33
▸ SLC6A3 Q01959 3/20 0.33
▸ TMEM97 Q5BJF2 2/20 0.33
▸ KCNK3 O14649 1/20 0.33
▸ FAAH O00519 7/20 0.33

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
SCHEMBL24046372 1.00 ADRB2 (0.38) ADRB2DAOHCRTR1HCRTR2KCNH2
SCHEMBL25695773 0.84 CYP3A4 (0.39) ADRB2KCNH2CYP3A4CYP2D6SLC6A2
SCHEMBL30219785 0.83 AKR1C3 (0.40) DAOCYP3A4CYP2D6SLC6A2SLC6A4
SCHEMBL30219781 0.83 AKR1C3 (0.40) DAOCYP3A4CYP2D6SLC6A2SLC6A4
SCHEMBL24046370 0.75 CYP1A2 (0.46) DAOCYP3A4CYP2D6
SCHEMBL30219766 0.75 CYP1A2 (0.46) DAOCYP3A4CYP2D6
SCHEMBL24046632 0.74 TSHR (0.40) ADRB2DAOKCNH2CYP3A4CYP2D6
SCHEMBL30219772 0.74 TSHR (0.40) ADRB2DAOKCNH2CYP3A4CYP2D6
SCHEMBL24046693 0.70 SIGMAR1 (0.44) DAOCYP3A4CYP2D6
SCHEMBL30219730 0.70 SIGMAR1 (0.44) DAOCYP3A4CYP2D6

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-4153175-A1 PIPERIDINE-2,6-DIONES AS SMALL MOLECULE DEGRADERS OF HELIOS AND METHODS OF USE Dana-Farber Cancer Institute, Inc. (US) 2023-03-29 — — EP disclosed
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