SCHEMBL31135206

SCHEMBL31135206

O=C(O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H](O)CN1C(=O)CNC(=O)[C@@H]1CCCN1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 16/20 0.49
▸ CHRM3 P20309 16/20 0.49
▸ CHRM4 P08173 15/20 0.49
▸ CHRM1 P11229 14/20 0.49
▸ CHRM5 P08912 12/20 0.46
▸ DPP4 P27487 2/20 0.39
▸ DPP8 Q6V1X1 2/20 0.39
▸ DPP9 Q86TI2 2/20 0.39

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
SCHEMBL29411122 1.00 CHRM2 (0.49) CHRM2CHRM3CHRM4CHRM1CHRM5
SCHEMBL30697793 1.00 CHRM2 (0.49) CHRM2CHRM3CHRM4CHRM1CHRM5
SCHEMBL29728563 0.96 CHRM2 (0.49) CHRM2CHRM3CHRM4CHRM1CHRM5
SCHEMBL29816632 0.88 DPP4 (0.44) CHRM2CHRM3CHRM4CHRM1CHRM5
SCHEMBL29816367 0.88 DPP4 (0.44) CHRM2CHRM3CHRM4CHRM1CHRM5
SCHEMBL29504152 0.88 DPP4 (0.44) CHRM2CHRM3CHRM4CHRM1CHRM5
SCHEMBL10793052 0.86 PREP (0.44) CHRM2CHRM3DPP4DPP8DPP9
SCHEMBL10793068 0.86 PREP (0.44) CHRM2CHRM3DPP4DPP8DPP9
SCHEMBL29816319 0.86 CHRM2 (0.47) CHRM2CHRM3CHRM4CHRM1CHRM5
SCHEMBL31497251 0.86 CHRM2 (0.47) CHRM2CHRM3CHRM4CHRM1CHRM5

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-118750586-A Collagen-based pharmaceutical compositions and devices and methods of manufacture and use thereof 莎思坦控股有限责任公司 2024-10-11 — — CN disclosed
CN-118750585-A Collagen-based pharmaceutical compositions and devices and methods of manufacture and use thereof 莎思坦控股有限责任公司 2024-10-11 — — CN disclosed
CN-118717953-A Collagen-based pharmaceutical compositions and devices and methods of manufacture and use thereof 莎思坦控股有限责任公司 2024-10-01 — — CN disclosed
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