SCHEMBL5691966

SCHEMBL5691966

[CH2]CC(Oc1ccc(CC(N)(C(=O)OCc2cccc3c2Cc2ccccc2-3)c2ccc(OC)cc2OC)cc1)C(N)=O

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ PTGDR2 Q9Y5Y4 1/20 0.30

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
SCHEMBL14714715 0.76 RAB9A (0.36) NPC1PKMRAB9A
SCHEMBL29714449 0.68 NPC1 (0.35) NPC1RAB9APOLBPTGDR2
SCHEMBL5188476 0.68 RAB9A (0.40) NPC1PKMRAB9APOLB
SCHEMBL31075128 0.67 ALDH1A1 (0.32) NPC1RAB9A
SCHEMBL38665543 0.66 RAB9A (0.40) NPC1PKMRAB9APOLB
SCHEMBL28815019 0.66 SMN1; SMN2 (0.46) NPC1RAB9APTGDR2
SCHEMBL28463245 0.66 PNMT (0.51) NPC1PKMRAB9A
SCHEMBL26105549 0.65 ESR1 (0.47) NPC1RAB9APOLB
SCHEMBL29004324 0.65 CD274 (0.48) PTGDR2
SCHEMBL7860715 0.64 KMT2A (0.42) NPC1PKMRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7132506-B2 Peptide having osteogenetic activity and osteogenetic accelerator containing the same KYOCERA CORPORATION (JP) 2006-11-07 — — US disclosed
EP-1288228-B1 BMP-2-derived peptides having osteogenetic activity and osteogenetic accelerator containing the same NISHIMURA YOSHIHIKO (JP) 2006-05-17 — — EP disclosed
US-20030082784-A1 Novel peptide having osteogenetic activity and osteogenetic accelerator containing the same YOSHIHIKO NISHIMURA 2003-05-01 — — US disclosed
EP-1288228-A1 BMP-2-derived peptides having osteogenetic activity and osteogenetic accelerator containing the same Nishimura, Yoshihiko (JP) 2003-03-05 — — EP disclosed
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