SCHEMBL9863146

SCHEMBL9863146

CCCCOC(=O)C1=C(C(=O)O)CCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.46
TDP1 Q9NUW8 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ATM Q13315 1/20 0.44
ESR1 P03372 7/20 0.44
MAPK1 P28482 3/20 0.44
LMNA P02545 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 1/20 0.44
NR1H2 P55055 1/20 0.44
RNASEL Q05823 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HCAR2 Q8TDS4 1/20 0.43
CHRM2 P08172 3/20 0.43
CHRM4 P08173 3/20 0.43
CHRM5 P08912 3/20 0.43
CHRM1 P11229 3/20 0.43
CHRM3 P20309 3/20 0.43
CYP3A4 P08684 3/20 0.42

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
SCHEMBL28077230 0.93 TSHR (0.49) TSHRESR1MAPK1LMNAHCAR2
SCHEMBL4449462 0.93 TSHR (0.49) TSHRTDP1L3MBTL1ATMESR1
SCHEMBL234625 0.93 TSHR (0.52) TSHRTDP1L3MBTL1ATMESR1
SCHEMBL28347013 0.89 LMNA (0.46) TSHRTDP1ESR1LMNASMN1; SMN2
SCHEMBL17744749 0.88 TSHR (0.53) TSHRESR1MAPK1LMNAHCAR2
SCHEMBL8975464 0.86 TSHR (0.54) TSHRESR1MAPK1LMNAHCAR2
SCHEMBL16732313 0.86 TSHR (0.54) TSHRESR1MAPK1LMNAHCAR2
SCHEMBL9863046 0.86 TSHR (0.54) TSHRESR1MAPK1LMNAHCAR2
SCHEMBL16732318 0.86 TSHR (0.54) TSHRESR1MAPK1LMNAHCAR2
SCHEMBL11564363 0.85 TSHR (0.55) TSHRTDP1L3MBTL1ATMESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4841003-A CCODINATION CATALYST CONTAINING MAGNESIUM, TITANIUM, HALOGEN, LEWIS BASE AND ORGANOALUMINUM COMPOUNDS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-06-20 US claimed
CN-109819654-B Solid catalyst component for olefin polymerization, process for producing the same, and process for producing olefin polymer 东邦钛株式会社 2021-11-16 CN disclosed
US-5075396-A Coordination catalyst comprising magnesium, titanium, halogen, aluminum, an organosilicon compound and a heterocyclic diester as electron donor; durability; stereospecific MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-12-24 US disclosed
EP-0115195-B1 CATALYST COMPOSITION FOR USE IN THE POLYMERIZATION OF OLEFINS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1990-09-26 EP disclosed
US-4841003-A CCODINATION CATALYST CONTAINING MAGNESIUM, TITANIUM, HALOGEN, LEWIS BASE AND ORGANOALUMINUM COMPOUNDS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1989-06-20 US disclosed
US-4725656-A COORDINATION CATALYST COMPRISING MAGNESIUM TITANIUM, ALUMINUM, ORGANO SILICON COMPOUNDS, AND POLYESTERS MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-02-16 US disclosed
EP-0115195-A1 Catalyst composition for use in the polymerization of olefins MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1984-08-08 EP disclosed