SCHEMBL27105309

SCHEMBL27105309

Cc1ccc(C(=O)O[C@@H]2[C@H](OC(=O)c3ccc(C)cc3)[C@@H]3C[C@H]2c2ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 2/20 0.50
▸ SCN1A P35498 1/20 0.47
▸ SCN2A Q99250 1/20 0.47
▸ SCN3A Q9NY46 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ LMNA P02545 1/20 0.44
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ LGALS9 O00182 1/20 0.41
▸ LGALS1 P09382 1/20 0.41
▸ LGALS3 P17931 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ CES2 O00748 1/20 0.41
▸ CES1 P23141 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ GAA P10253 2/20 0.40

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
SCHEMBL24278598 1.00 ABCB1 (0.50) ABCB1SCN1ASCN2ASCN3ATDP1
SCHEMBL25755273 1.00 ABCB1 (0.50) ABCB1SCN1ASCN2ASCN3ATDP1
SCHEMBL27105312 0.92 NPSR1 (0.47) ABCB1SCN1ASCN2ASCN3ATDP1
SCHEMBL27052109 0.92 NPSR1 (0.47) ABCB1SCN1ASCN2ASCN3ATDP1
SCHEMBL27053482 0.92 NPSR1 (0.47) ABCB1SCN1ASCN2ASCN3ATDP1
SCHEMBL27053494 0.91 ABCB1 (0.47) ABCB1SCN1ASCN2ASCN3ATDP1
SCHEMBL27053452 0.87 CHRNA7 (0.49) KMT2AMEN1LMNALGALS9LGALS1
SCHEMBL25755225 0.87 CHRNA7 (0.49) KMT2AMEN1LMNALGALS9LGALS1
SCHEMBL24278683 0.87 CHRNA7 (0.49) KMT2AMEN1LMNALGALS9LGALS1
SCHEMBL25796830 0.87 CHRNA7 (0.49) KMT2AMEN1LMNALGALS9LGALS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067763-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION METHOD, AND PROPYLENE POLYMER MITSUI CHEMICALS, INC. (JP) 2024-02-29 — — US disclosed
US-20240067763-A1 SOLID TITANIUM CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, OLEFIN POLYMERIZATION METHOD, AND PROPYLENE POLYMER MITSUI CHEMICALS, INC. (JP) 2024-02-29 — — US disclosed
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