SCHEMBL25899215

SCHEMBL25899215

COC(=O)C(c1cc(OCC2(C)CCN(C(=O)OC(C)(C)C)CC2)no1)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.40
SCD5 Q86SK9 1/20 0.38
TSHR P16473 3/20 0.38
ALOX15 P16050 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NAMPT P43490 6/20 0.36
CYP2C9 P11712 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
USP30 Q70CQ3 1/20 0.35
GPR119 Q8TDV5 1/20 0.35

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
SCHEMBL25308912 0.91 SCD5 (0.41) PKMSCD5TSHRALOX15USP30
SCHEMBL25427023 0.90 PKM (0.42) PKMSCD5TSHRALOX15MEN1
SCHEMBL24756985 0.83 KDM4E (0.42) PKMMEN1KMT2AMAPTGPR119
SCHEMBL21456251 0.82 SCN9A (0.46) PKMGPR119
SCHEMBL28983615 0.82 TSHR (0.40) PKMSCD5TSHRALOX15USP30
SCHEMBL25899635 0.81 GABRA5 (0.39) NAMPTUSP30GPR119
SCHEMBL30187253 0.81 GPR119 (0.43) PKMMEN1KMT2AMAPTUSP30
SCHEMBL25899721 0.80 GPR119 (0.46) MAPTUSP30GPR119
SCHEMBL25309700 0.79 PKM (0.44) PKMSCD5TSHRALOX15NAMPT
SCHEMBL25308936 0.79 PKM (0.44) PKMSCD5TSHRALOX15NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023141570-A9 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF KRAS ARVINAS OPERATIONS, INC. (US) 2024-06-27 WO disclosed
WO-2023141570-A2 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF KRAS ARVINAS OPERATIONS, INC. (US) 2023-07-27 WO disclosed
CN-115803030-A Compounds and methods for KRAS-targeted degradation 阿维纳斯企业公司 2023-03-14 CN disclosed
EP-4132655-A1 COMPOUNDS AND METHODS FOR TARGETED DEGRADATION OF KRAS Arvinas Operations, Inc. (US) 2023-02-15 EP disclosed