SCHEMBL25741981

SCHEMBL25741981

F[C@H]1C[C@@H](I)CN(Cc2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FUCA1 P04066 2/20 0.50
SIGMAR1 Q99720 1/20 0.47
S1PR1 P21453 1/20 0.44
S1PR5 Q9H228 1/20 0.44
GBA1 P04062 1/20 0.43
RORC P51449 1/20 0.42
ACHE P22303 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KDM1A O60341 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
SCHEMBL14742553 0.85 FUCA1 (0.60) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL20745525 0.81 FUCA1 (0.49) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL25740973 0.81 HRH3 (0.57) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL16764857 0.81 FUCA1 (0.49) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL23159839 0.81 FUCA1 (0.57) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL23162411 0.81 FUCA1 (0.57) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL16764982 0.81 FUCA1 (0.49) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL16525718 0.81 HRH3 (0.57) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL21483083 0.81 HRH3 (0.57) FUCA1SIGMAR1S1PR1S1PR5GBA1
SCHEMBL20858838 0.79 FUCA1 (0.53) FUCA1SIGMAR1S1PR1S1PR5GBA1

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-2023122581-A2 IKAROS ZINC FINGER FAMILY DEGRADERS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2023-06-29 WO disclosed