SCHEMBL31677263

SCHEMBL31677263

COc1ccc(C(=O)N2CCC3(CC2)CC(CCN2CCNCC2)C3)cc1N1CCC(=O)NC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 2/20 0.41
▸ MLKL Q8NB16 1/20 0.39
▸ CRBN Q96SW2 1/20 0.39
▸ CYP2D6 P10635 4/20 0.37
▸ USP2 O75604 1/20 0.37
▸ NR3C1 P04150 1/20 0.37
▸ PGR P06401 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ PDE3B Q13370 1/20 0.37
▸ PDE3A Q14432 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ MAP1LC3B Q9GZQ8 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TNKS O95271 1/20 0.36
▸ PARP1 P09874 1/20 0.36
▸ PARP10 Q53GL7 1/20 0.36
▸ TNKS2 Q9H2K2 1/20 0.36
▸ GABRD O14764 2/20 0.36
▸ GABRA1 P14867 2/20 0.36

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
SCHEMBL30863989 0.89 SOS1 (0.42) SOS1MLKLCRBNCYP2D6USP2
SCHEMBL30816879 0.86 SOS1 (0.50) SOS1MLKLCRBNCYP2D6USP2
SCHEMBL30267496 0.84 GABRD (0.51) MLKLCRBNCYP2D6USP2NR3C1
SCHEMBL21408866 0.84 GABRD (0.51) MLKLCRBNCYP2D6USP2NR3C1
SCHEMBL30267244 0.84 SOS1 (0.42) SOS1MLKLCRBNCYP2D6USP2
SCHEMBL24735010 0.83 NR3C1 (0.47) NR3C1PGRSLC6A4KCNH2PDE3B
SCHEMBL29841507 0.83 NR3C1 (0.47) NR3C1PGRSLC6A4KCNH2PDE3B
SCHEMBL31447662 0.83 SOS1 (0.44) SOS1NR3C1PGRSLC6A4KCNH2
Hydrochloric Acid SCHEMBL29841613 0.82 NR3C1 (0.46) NR3C1PGRSLC6A4KCNH2PDE3B
SCHEMBL31677340 0.82 SOS1 (0.41) SOS1MLKLCRBNCYP2D6USP2

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-4606803-A1 KRAS G12D DEGRADATION AGENT, AND PREPARATION METHOD AND USE THEREFOR Leadingtac Pharmaceutical (Shaoxing) Co., Ltd. (CN) 2025-08-27 — — EP disclosed
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