SCHEMBL9628186

SCHEMBL9628186

CC(=O)Oc1ccc(C(=O)OCC[C@H](C)COC(=O)c2ccc(OC(C)=O)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ ELANE P08246 3/20 0.47
▸ ADRB2 P07550 1/20 0.43
▸ ADRB1 P08588 1/20 0.43
▸ ADRB3 P13945 1/20 0.43
▸ KMT2A Q03164 3/20 0.42
▸ ACHE P22303 1/20 0.42
▸ LMNA P02545 3/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ CYP2C19 P33261 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ESR1 P03372 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ NR1H2 P55055 1/20 0.41
▸ RNASEL Q05823 1/20 0.41
▸ CYP3A4 P08684 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
SCHEMBL9628197 1.00 MAPT (0.52) MAPTHSD17B10MAPK1PKMELANE
SCHEMBL9512465 0.87 MAPT (0.69) MAPTHSD17B10ELANEADRB2ADRB1
SCHEMBL10423302 0.85 HSD17B10 (0.50) MAPTHSD17B10MAPK1PKMELANE
SCHEMBL9579629 0.83 ELANE (0.54) MAPTHSD17B10MAPK1PKMELANE
SCHEMBL10423598 0.83 HSD17B10 (0.58) MAPTHSD17B10MAPK1PKMELANE
SCHEMBL10422606 0.83 MAPT (0.64) MAPTHSD17B10ELANEADRB2ADRB1
SCHEMBL9627889 0.82 ESR1 (0.60) MAPTHSD17B10MAPK1PKMADRB2
SCHEMBL9627881 0.82 ESR1 (0.60) MAPTHSD17B10MAPK1PKMADRB2
SCHEMBL14399226 0.81 KMT2A (0.46) MAPTHSD17B10MAPK1PKMELANE
SCHEMBL9446645 0.80 LMNA (0.57) MAPTHSD17B10MAPK1ELANEKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0311257-B1 CHOLESTERIC LIQUID CRYSTAL POLYESTERS NIPPON OIL CO. LTD. (JP) 1992-05-06 — — EP disclosed
US-4891418-A MELT PROCESSABILITY NIPPON OIL COMPANY, LTD. (JP) 1990-01-02 — — US disclosed
EP-0311257-A1 Cholesteric liquid crystal polyesters NIPPON OIL CO. LTD. (JP) 1989-04-12 — — EP disclosed
US-4746722-A HIGH STRENGTH AND MODULUS, REDUCED ANISOTROPY NIPPON OIL COMPANY, LIMITED (JP) 1988-05-24 — — US disclosed
EP-0251688-A2 Cholesteric liquid crystal polyesters NIPPON OIL CO. LTD. (JP) 1988-01-07 — — EP disclosed
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