SCHEMBL9320720

SCHEMBL9320720

C=CCOC(C)Oc1ccc(C2(c3ccc(OC(C)OCC=C)cc3)CCC(c3ccc(OC(C)OCC=C)cc3)(c3ccc(OC(C)OCC=C)cc3)CC2)cc1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 1/20 0.35
▸ MMP2 P08253 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ CYP2D6 P10635 1/20 0.31
▸ SLC6A4 P31645 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.30
▸ PSMB1 P20618 1/20 0.30
▸ PSMB5 P28074 1/20 0.30
▸ PSMB2 P49721 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
SCHEMBL9320644 0.89 MMP1 (0.33) MMP1MMP2MMP9CYP2D6SLC6A4
SCHEMBL28567449 0.76 MEN1 (0.40) MEN1KMT2A
SCHEMBL11696945 0.75 MEN1 (0.41) MEN1KMT2A
SCHEMBL15869202 0.75 ADORA3 (0.43) SLC6A4MEN1KMT2AADORA3PSMB1
SCHEMBL8755128 0.75 ALDH1A1 (0.36) CYP2D6SLC6A4MEN1KMT2APSMB1
SCHEMBL15869191 0.74 ADORA3 (0.45) SLC6A4ADORA3PSMB1PSMB5PSMB2
SCHEMBL14066240 0.72 MAPT (0.36) MMP1MMP2MMP9SLC6A4MEN1
SCHEMBL9320722 0.70 PSMB1 (0.44) MMP1MMP2MMP9MEN1KMT2A
SCHEMBL826438 0.69 PSMB1 (0.50) MMP1MMP2MMP9CYP2D6MEN1
SCHEMBL15869192 0.69 DRD2 (0.33) SLC6A4MEN1KMT2AADORA3

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
EP-0464408-B1 Process for preparing star compounds SEKISUI CHEMICAL CO LTD (JP) 1994-01-12 — — EP disclosed
US-5102966-A Addition polymerization of unsaturated ethers using an unsaturated alkenyl polyether adduct as initiator and a cation-donating compound SEKISUI CHEMICAL CO., LTD. (JP) 1992-04-07 — — US disclosed
EP-0464408-A1 Process for preparing star compounds SEKISUI CHEMICAL CO., LTD. (JP) 1992-01-08 — — EP disclosed
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