SCHEMBL29182754

SCHEMBL29182754

CC(C)(C)OC(=O)N1CCN(c2cc(I)cc(F)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.49
▸ SKP1 P63208 2/20 0.49
▸ SKP2 Q13309 2/20 0.49
▸ MAP4K4 O95819 1/20 0.47
▸ GPR119 Q8TDV5 9/20 0.46
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ GALR2 O43603 1/20 0.43
▸ GALR1 P47211 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ SUV39H2 Q9H5I1 1/20 0.42
▸ SMARCA2 P51531 1/20 0.42
▸ SMARCA4 P51532 1/20 0.42
▸ PBRM1 Q86U86 1/20 0.42
▸ GRIA1 P42261 1/20 0.41
▸ PDK2 Q15119 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
SCHEMBL15047026 0.81 CKS1B (0.56) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL21796663 0.80 GPR119 (0.56) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL18551087 0.80 GPR119 (0.54) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL29182760 0.79 HRH4 (0.45) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL24851455 0.79 CKS1B (0.53) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL31383499 0.79 CKS1B (0.48) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL21796860 0.78 CKS1B (0.47) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL26924817 0.78 GPR119 (0.50) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL16333288 0.78 CKS1B (0.53) CKS1BSKP1SKP2MAP4K4GPR119
SCHEMBL20142337 0.77 CKS1B (0.59) CKS1BSKP1SKP2MAP4K4GPR119

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-4351560-A1 ANTICANCER COMPOUNDS The Regents of the University of California (US) 2024-04-17 — — EP disclosed
CN-117794525-A Anticancer compounds 加利福尼亚大学董事会 2024-03-29 — — CN disclosed
WO-2022261204-A1 ANTICANCER COMPOUNDS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-12-15 — — WO disclosed
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