SCHEMBL25330636

SCHEMBL25330636

CCOC(=O)C1CCN(c2ccc(C3CCN(C(=O)OC(C)(C)C)CC3)c(F)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LGMN Q99538 2/20 0.53
GPR119 Q8TDV5 11/20 0.52
PDK2 Q15119 1/20 0.47
MAPT P10636 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TP53 P04637 1/20 0.45
POLB P06746 1/20 0.45

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
SCHEMBL19078350 0.82 STS (0.46) LGMNGPR119ALDH1A1MEN1KMT2A
SCHEMBL25942333 0.82 LGMN (0.55) LGMNPDK2MAPTALDH1A1MEN1
SCHEMBL17305269 0.82 NPSR1 (0.52) LGMNMAPTALDH1A1MEN1KMT2A
Hydrochloric Acid SCHEMBL25431314 0.81 LGMN (0.54) LGMNPDK2MAPTALDH1A1MEN1
SCHEMBL20522647 0.81 ALDH1A1 (0.53) LGMNMAPTALDH1A1MEN1KMT2A
SCHEMBL20522653 0.81 HPGD (0.48) ALDH1A1MEN1KMT2ASMN1; SMN2POLB
SCHEMBL19078363 0.80 ALDH1A1 (0.47) LGMNGPR119MAPTALDH1A1MEN1
SCHEMBL17305397 0.80 HTT (0.55) LGMNGPR119MAPTALDH1A1MEN1
SCHEMBL27359025 0.80 GPR119 (0.55) GPR119MAPTALDH1A1MEN1KMT2A
SCHEMBL25426990 0.80 LGMN (0.51) LGMNPDK2MAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4466260-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER Astrazeneca AB (SE) 2024-11-27 EP disclosed
WO-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 WO disclosed
WO-2023139199-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER ASTRAZENECA AB (SE) 2023-07-27 WO disclosed