SCHEMBL6547512

SCHEMBL6547512

CC(=Cc1ccccc1C)C(C)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
TSHR P16473 1/20 0.39
NOS2 P35228 1/20 0.37
TRPA1 O75762 1/20 0.36
PTGS2 P35354 1/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34
MAPT P10636 2/20 0.34
ACP3 P15309 1/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
ALOX15 P16050 1/20 0.34
ALOX12 P18054 1/20 0.34
RECQL P46063 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ADRA2A P08913 1/20 0.33
ADRA2C P18825 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL18677500 0.81 ALDH1A1 (0.45) ALDH1A1TSHRKDM4EHPGDMAPT
SCHEMBL6546438 0.77 ALDH1A1 (0.45) ALDH1A1TSHRTRPA1PTGS2KDM4E
SCHEMBL6546433 0.77 ALDH1A1 (0.45) ALDH1A1TSHRTRPA1PTGS2KDM4E
SCHEMBL14425932 0.75 TDP1 (0.41) ALDH1A1TSHRKDM4EHPGDMAPT
SCHEMBL24831361 0.74 TRPA1 (0.44) ALDH1A1TSHRNOS2TRPA1PTGS2
SCHEMBL24279195 0.74 ALDH1A1 (0.38) ALDH1A1TSHRKDM4EMAPTCYP1A2
SCHEMBL257719 0.72 ALDH1A1 (0.52) ALDH1A1TSHRKDM4EHPGDMAPT
SCHEMBL28884899 0.71 RAB9A (0.41) ALDH1A1TSHRPTGS2KDM4EMAPT
SCHEMBL6435581 0.71 LMNA (0.43) ALDH1A1TSHRTRPA1KDM4EGAA
SCHEMBL6435574 0.71 LMNA (0.43) ALDH1A1TSHRTRPA1KDM4EGAA

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