SCHEMBL29551015

SCHEMBL29551015

CC(C)(C)OC(=O)N1CCC2(CC1)Cc1cccc(C#N)c1[C@@H]2N[S+]([O-])C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.39
▸ TSHR P16473 2/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ KDM1A O60341 1/20 0.36
▸ NAMPT P43490 6/20 0.36
▸ EGLN2 Q96KS0 1/20 0.35
▸ NOTCH1 P46531 1/20 0.34
▸ ATM Q13315 1/20 0.34

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
SCHEMBL24282593 1.00 GPR119 (0.39) GPR119TSHRALOX15KDM1ANAMPT
SCHEMBL29550726 1.00 GPR119 (0.39) GPR119TSHRALOX15KDM1ANAMPT
SCHEMBL23046171 1.00 GPR119 (0.39) GPR119TSHRALOX15KDM1ANAMPT
SCHEMBL23024208 0.89 F11 (0.32) —
SCHEMBL23024207 0.89 F11 (0.32) —
SCHEMBL30568087 0.88 GPR119 (0.39) GPR119TSHRALOX15NAMPTEGLN2
SCHEMBL23508820 0.86 GPR119 (0.39) GPR119TSHRALOX15KDM1ANAMPT
SCHEMBL23046244 0.86 GPR119 (0.39) GPR119TSHRALOX15KDM1ANAMPT
SCHEMBL23046243 0.86 GPR119 (0.39) GPR119TSHRALOX15KDM1ANAMPT
SCHEMBL29892178 0.86 GPR119 (0.39) GPR119TSHRALOX15KDM1ANAMPT

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
EP-3984999-A1 SHP2 PHOSPHATASE ALLOSTERIC INHIBITOR Beijing Shenogen Pharma Group Ltd. (CN) 2022-04-20 — — EP disclosed
Send feedback