SCHEMBL30509486

SCHEMBL30509486

Fc1ccc(-c2ccnn2C2CCCCO2)nc1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 6/20 0.58
CYP4A11 Q02928 6/20 0.58
ATR Q13535 14/20 0.53

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
SCHEMBL9977805 1.00 CYP4F2 (0.58) CYP4F2CYP4A11ATR
SCHEMBL19277442 0.85 CYP4F2 (0.64) CYP4F2CYP4A11ATR
SCHEMBL18034742 0.85 CYP4F2 (0.57) CYP4F2CYP4A11ATR
SCHEMBL9977842 0.84 CYP4F2 (0.54) CYP4F2CYP4A11ATR
SCHEMBL24409265 0.82 CYP4F2 (0.58) CYP4F2CYP4A11ATR
SCHEMBL19276681 0.81 CYP4F2 (0.65) CYP4F2CYP4A11ATR
SCHEMBL13734367 0.80 CYP4F2 (0.53) CYP4F2CYP4A11ATR
SCHEMBL25257638 0.80 CYP4F2 (0.53) CYP4F2CYP4A11ATR
SCHEMBL19277056 0.80 CYP4F2 (0.68) CYP4F2CYP4A11ATR
SCHEMBL25325198 0.79 CYP4F2 (0.42) CYP4F2CYP4A11ATR

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
EP-4214199-A1 CASEIN KINASE 1 DELTA MODULATORS JANSSEN Pharmaceutica NV (BE) 2023-07-26 EP disclosed
CN-116490503-A Casein kinase 1 delta modulators 詹森药业有限公司 2023-07-25 CN disclosed