SCHEMBL6546983

SCHEMBL6546983

CCc1ccc(C(C)Cc2ccc(C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.57
ESR2 Q92731 2/20 0.57
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ACHE P22303 2/20 0.42
GRIA4 P48058 1/20 0.40
STAT3 P40763 1/20 0.39
IDO1 P14902 1/20 0.37
NR3C1 P04150 1/20 0.36
PGR P06401 1/20 0.36
NR3C2 P08235 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BCHE P06276 1/20 0.36
HCRTR2 O43614 2/20 0.35
PTGS1 P23219 3/20 0.35
PTGS2 P35354 3/20 0.35
LMNA P02545 2/20 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
SCHEMBL6546854 1.00 ESR1 (0.57) ESR1ESR2TSHRMAPK1ATM
SCHEMBL6547203 0.92 ESR1 (0.65) ESR1ESR2TSHRACHEGRIA4
SCHEMBL6546198 0.84 ESR1 (0.57) ESR1ESR2TSHRMAPK1ATM
SCHEMBL1954002 0.82 ESR1 (0.85) ESR1ESR2MAPK1L3MBTL1ACHE
SCHEMBL21699675 0.82 ESR1 (0.55) ESR1ESR2TSHRMAPK1ATM
SCHEMBL1841040 0.82 ESR1 (0.85) ESR1ESR2MAPK1L3MBTL1ACHE
SCHEMBL2844467 0.82 ESR1 (0.55) ESR1ESR2L3MBTL1ACHESMN1; SMN2
SCHEMBL1842701 0.82 ESR1 (0.85) ESR1ESR2MAPK1TDP1L3MBTL1
SCHEMBL1952940 0.82 ESR1 (0.85) ESR1ESR2MAPK1TDP1L3MBTL1
SCHEMBL5313594 0.82 ESR1 (0.53) ESR1ESR2ACHESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0717098-B1 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON MITSUBISHI OIL CORP (JP) 2004-01-21 EP disclosed
US-5817251-A AROMATIC HYDROCARBON LUBRICANT NIPPON OIL CO., LTD. (JP) 1998-10-06 US disclosed
US-5711895-A Fluid composition for use in a refrigerating machine in which the refrigerating machine oil is at least one hydrocarbon compound of a formula consisting of two phenyl groups joined through an alkylene or alkenylene group NIPPON OIL CO., LTD. (JP) 1998-01-27 US disclosed
EP-0717098-A2 A refrigerating machine oil and a fluid composition for use in a refrigerating machine NIPPON OIL CO. LTD. (JP) 1996-06-19 EP disclosed