SCHEMBL27105259

SCHEMBL27105259

C[C@]12c3ccccc3[C@](Oc3ccccc3)(c3ccccc31)C(OC(=O)c1ccccc1)C2OC(=O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.43
▸ LMNA P02545 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ TSHR P16473 3/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ F2 P00734 1/20 0.37
▸ CHRNA7 P36544 2/20 0.37
▸ HTR3E A5X5Y0 1/20 0.37
▸ HTR3B O95264 1/20 0.37
▸ HTR3A P46098 1/20 0.37
▸ HTR3D Q70Z44 1/20 0.37
▸ HTR3C Q8WXA8 1/20 0.37
▸ ABCB1 P08183 5/20 0.36
▸ APOBEC3A P31941 1/20 0.36
▸ APOBEC3G Q9HC16 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL27105330 0.89 GAA (0.51) GAALMNATDP1TSHRKMT2A
SCHEMBL27053178 0.89 GAA (0.51) GAALMNATDP1TSHRKMT2A
SCHEMBL27061699 0.89 GAA (0.51) GAALMNATDP1TSHRKMT2A
SCHEMBL27053197 0.87 GAA (0.44) GAALMNATDP1TSHRKMT2A
SCHEMBL27053536 0.87 GAA (0.44) GAALMNATDP1TSHRKMT2A
SCHEMBL27053426 0.83 GAA (0.38) GAALMNATDP1TSHRKMT2A
SCHEMBL27105258 0.83 TSHR (0.42) GAALMNATDP1TSHRKMT2A
SCHEMBL27105253 0.83 GAA (0.42) GAALMNATDP1TSHRKMT2A
SCHEMBL27105254 0.83 GAA (0.42) GAALMNATDP1TSHRKMT2A
SCHEMBL27062724 0.82 GAA (0.39) GAALMNATDP1TSHRKMT2A

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 1 patent. 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
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