SCHEMBL30009715

SCHEMBL30009715

O=C1CCN(c2cc(C(=O)N3CCC(CN4CCNCC4)CC3)ccc2Cl)C(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 2/20 0.38
▸ HSD11B1 P28845 1/20 0.38
▸ CCR3 P51677 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ HRH1 P35367 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ LIPG Q9Y5X9 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
SCHEMBL23121762 1.00 MGLL (0.38) MGLLHSD11B1CCR3TSHRNPSR1
Hydrochloric Acid SCHEMBL23121946 0.99 MGLL (0.37) MGLLHSD11B1CCR3TSHRNPSR1
Hydrochloric Acid SCHEMBL30009282 0.99 MGLL (0.37) MGLLHSD11B1CCR3TSHRNPSR1
SCHEMBL27123617 0.92 SOS1 (0.40) MGLL
SCHEMBL28783591 0.90 CCR3 (0.38) MGLLHSD11B1CCR3TSHRHRH1
SCHEMBL23134613 0.90 TSHR (0.40) MGLLHSD11B1TSHRNPSR1KCNH2
SCHEMBL31677169 0.89 HRH3 (0.38) MGLLHSD11B1CCR3LIPG
SCHEMBL24671840 0.89 HSD11B1 (0.39) MGLLHSD11B1
SCHEMBL30066376 0.89 HSD11B1 (0.39) MGLLHSD11B1
SCHEMBL31255494 0.89 TPSAB1 (0.42) MGLLHSD11B1CCR3TSHRNPSR1

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-4041724-A1 BRD9 BIFUNCTIONAL DEGRADERS AND THEIR METHODS OF USE Novartis AG (CH) 2022-08-17 — — EP disclosed
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