SCHEMBL30233047

SCHEMBL30233047

CCn1nc(C)cc1Cn1cnc2ccc(C(=O)OC)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.48
▸ RAB9A P51151 4/20 0.46
▸ GAA P10253 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.43
▸ POLB P06746 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ USP2 O75604 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ FGFR1 P11362 2/20 0.40
▸ F10 P00742 2/20 0.39
▸ ACSS2 Q9NR19 1/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MTNR1A P48039 1/20 0.38
▸ MTNR1B P49286 1/20 0.38
▸ CNR1 P21554 1/20 0.38
▸ F2 P00734 1/20 0.38

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
SCHEMBL30686432 0.88 HCAR3 (0.43) LMNAFGFR1F10ALDH1A1F2
SCHEMBL30686444 0.84 BRD4 (0.48) BRD4RAB9AGAAKDM4EPOLB
SCHEMBL31202855 0.83 BRD4 (0.46) BRD4RAB9AGAAKDM4EPOLB
SCHEMBL17263019 0.81 KDM4E (0.51) BRD4RAB9AKDM4EPOLBMAPT
SCHEMBL29559350 0.81 BRD4 (0.47) BRD4RAB9AKDM4EPOLBMAPT
SCHEMBL30233119 0.78 BRD4 (0.49) BRD4RAB9AKDM4EPOLBMAPT
SCHEMBL30233099 0.77 CYP11B1 (0.55) LMNASMN1; SMN2MAPK1ALDH1A1
SCHEMBL17807884 0.76 BRD4 (0.59) BRD4SMN1; SMN2FGFR1ALDH1A1CNR1
SCHEMBL30202437 0.76 BRD4 (0.59) BRD4SMN1; SMN2FGFR1ALDH1A1CNR1
SCHEMBL30232676 0.74 BRD4 (0.46) BRD4RAB9AKDM4EPOLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117242067-B Novel aryl ether substituted heterocycles as GLP1R agonists 杭州德睿智药科技有限公司 2025-03-25 — — CN disclosed
CN-117242067-A Novel aryl ether substituted heterocycles as GLP1R agonists 杭州德睿智药科技有限公司 2023-12-15 — — CN disclosed
WO-2023029380-A1 NOVEL ARYL ETHER SUBSTITUTED HETEROCYCLIC COMPOUND AS GLP1R AGONIST 杭州德睿智药科技有限公司 2023-03-09 — — WO disclosed
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