SCHEMBL25975792

SCHEMBL25975792

FC(F)CN1CCc2ccccc2C1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.56
PRMT5 O14744 12/20 0.55
WDR77 Q9BQA1 10/20 0.55
HTT P42858 2/20 0.53
KDM4E B2RXH2 1/20 0.53
MAPK1 P28482 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
LMNA P02545 1/20 0.51

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
SCHEMBL17306996 0.83 CARM1 (0.55) CARM1PRMT5WDR77HTTLMNA
SCHEMBL15830399 0.83 CARM1 (0.55) CARM1PRMT5WDR77
SCHEMBL3418321 0.81 CARM1 (0.60) CARM1PRMT5WDR77HTTLMNA
SCHEMBL30019323 0.81 CARM1 (0.74) CARM1PRMT5WDR77HTTLMNA
SCHEMBL5451149 0.80 LMNA (0.61) CARM1PRMT5WDR77HTTKDM4E
SCHEMBL25910580 0.80 CARM1 (0.71) CARM1PRMT5WDR77HTTKDM4E
SCHEMBL20042490 0.80 CARM1 (0.71) CARM1PRMT5WDR77HTTKDM4E
SCHEMBL13875133 0.80 CARM1 (0.71) CARM1PRMT5WDR77HTTKDM4E
SCHEMBL25059799 0.79 CARM1 (0.57) CARM1PRMT5WDR77HTTLMNA
SCHEMBL22527575 0.79 CARM1 (0.61) CARM1PRMT5WDR77HTTLMNA

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-2023154282-A1 COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS THERAS, INC. (US) 2023-08-17 WO disclosed