SCHEMBL29201734

SCHEMBL29201734

O=CCC1CCN(C(=O)c2ccc(Cl)c(N3CCC(=O)NC3=O)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.42
▸ HSD11B1 P28845 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ CCR3 P51677 1/20 0.41
▸ HPGD P15428 1/20 0.40

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
SCHEMBL27121574 0.92 FFAR4 (0.40) MGLLHSD11B1HPGD
SCHEMBL29201772 0.90 HSD11B1 (0.39) MGLLHSD11B1TSHRCCR3
SCHEMBL29201724 0.89 HTR1A (0.38) MGLLHSD11B1CCR3
SCHEMBL31524299 0.88 MGLL (0.41) MGLLHSD11B1TSHR
SCHEMBL28868792 0.87 HSD11B1 (0.40) MGLLHSD11B1TSHRCCR3HPGD
SCHEMBL29201743 0.87 MGLL (0.42) MGLLHSD11B1TSHRHPGD
SCHEMBL30015013 0.86 TSHR (0.43) MGLLHSD11B1TSHRCCR3
SCHEMBL25221532 0.85 NR3C1 (0.42) MGLLHSD11B1HPGD
SCHEMBL29384475 0.85 NR3C1 (0.42) MGLLHSD11B1HPGD
SCHEMBL31255494 0.85 TPSAB1 (0.42) MGLLHSD11B1TSHRCCR3

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
CN-117917416-A KRAS G12D degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-04-23 — — CN disclosed
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