SCHEMBL31677307

SCHEMBL31677307

COc1ccc(C(=O)N2CCC3(CCN(CC4CN(C(=O)OC(C)(C)C)C4)CC3)CC2)cc1N1CCC(=O)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 2/20 0.44
▸ CYP2D6 P10635 5/20 0.39
▸ USP2 O75604 2/20 0.39
▸ TSHR P16473 3/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CRBN Q96SW2 2/20 0.38
▸ MLKL Q8NB16 1/20 0.38
▸ DDB1 Q16531 1/20 0.38
▸ CYP3A4 P08684 3/20 0.38
▸ ROCK2 O75116 1/20 0.37
▸ KCNH2 Q12809 4/20 0.37
▸ CCR8 P51685 3/20 0.37
▸ TNKS O95271 1/20 0.37
▸ PARP1 P09874 1/20 0.37
▸ PARP10 Q53GL7 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ PGR P06401 1/20 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
SCHEMBL30864059 1.00 SOS1 (0.44) SOS1CYP2D6USP2TSHRSMN1; SMN2
SCHEMBL31677340 0.92 SOS1 (0.41) SOS1CYP2D6USP2TSHRSMN1; SMN2
SCHEMBL30864141 0.92 SOS1 (0.41) SOS1CYP2D6USP2TSHRSMN1; SMN2
SCHEMBL30984835 0.91 SOS1 (0.51) SOS1CYP2D6USP2CRBNMLKL
SCHEMBL30148829 0.90 CRBN (0.42) SOS1CYP2D6USP2TSHRSMN1; SMN2
SCHEMBL25583436 0.87 SOS1 (0.44) SOS1SMN1; SMN2CRBNDDB1ROCK2
SCHEMBL30864007 0.86 SOS1 (0.46) SOS1CYP2D6USP2TSHRSMN1; SMN2
SCHEMBL31586864 0.86 ACACB (0.47) SOS1USP2TSHRCRBNMLKL
SCHEMBL31255654 0.85 SOS1 (0.43) SOS1CRBNDDB1PDE4APDE4B
SCHEMBL30874160 0.84 ACACB (0.47) CRBNMLKLDDB1KCNH2PARP1

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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