SCHEMBL27105330

SCHEMBL27105330

C[C@]12c3ccccc3[C@](C)(c3ccccc31)[C@@H](OC(=O)c1ccccc1)[C@H]2OC(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.51
▸ TSHR P16473 4/20 0.47
▸ LMNA P02545 3/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ F2 P00734 1/20 0.45
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ CHRNA7 P36544 2/20 0.43
▸ HTR3E A5X5Y0 1/20 0.43
▸ HTR3B O95264 1/20 0.43
▸ HTR3A P46098 1/20 0.43
▸ HTR3D Q70Z44 1/20 0.43
▸ HTR3C Q8WXA8 1/20 0.43
▸ APOBEC3A P31941 1/20 0.42
▸ APOBEC3G Q9HC16 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ ABCB1 P08183 2/20 0.40
▸ SLC6A3 Q01959 1/20 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
SCHEMBL27053178 1.00 GAA (0.51) GAATSHRLMNATDP1F2
SCHEMBL27061699 1.00 GAA (0.51) GAATSHRLMNATDP1F2
SCHEMBL27053536 0.91 GAA (0.44) GAATSHRLMNATDP1F2
SCHEMBL27053197 0.91 GAA (0.44) GAATSHRLMNATDP1F2
SCHEMBL27105259 0.89 GAA (0.43) GAATSHRLMNATDP1F2
SCHEMBL27053200 0.88 GAA (0.43) GAATSHRLMNATDP1F2
SCHEMBL27105254 0.87 GAA (0.42) GAATSHRLMNATDP1F2
SCHEMBL27105253 0.87 GAA (0.42) GAATSHRLMNATDP1F2
SCHEMBL27053518 0.87 GAA (0.42) GAATSHRLMNATDP1F2
SCHEMBL27053198 0.87 GAA (0.42) GAATSHRLMNATDP1KMT2A

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
Send feedback