SCHEMBL6547008

SCHEMBL6547008

Cc1ccc(CC(C)CCc2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.49
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
SIGMAR1 Q99720 7/20 0.44
SLC6A2 P23975 2/20 0.44
TAAR1 Q96RJ0 2/20 0.44
MAOA P21397 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44
CYP2A6 P11509 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA1 P30542 1/20 0.44
POLB P06746 1/20 0.44
MMP8 P22894 1/20 0.43

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
SCHEMBL6546874 1.00 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ATDP1L3MBTL1
SCHEMBL3082123 0.90 SIGMAR1 (0.52) MEN1KMT2ASIGMAR1SLC6A2TAAR1
SCHEMBL11289313 0.85 TP53 (0.52) MEN1KMT2ASIGMAR1SLC6A2TAAR1
SCHEMBL3215341 0.84 OPRK1 (0.59) MEN1KMT2ASIGMAR1SLC6A2TAAR1
SCHEMBL19881142 0.81 SLC6A4 (0.60) MEN1KMT2ASIGMAR1SLC6A2TAAR1
SCHEMBL4785593 0.80 TSHR (0.52) ALDH1A1MEN1KMT2APOLB
SCHEMBL3015704 0.79 ALDH1A1 (0.45) ALDH1A1TDP1L3MBTL1SIGMAR1MMP8
SCHEMBL6286870 0.79 SIGMAR1 (0.55) SIGMAR1SLC6A2TAAR1MAOASLC6A4
SCHEMBL21361484 0.78 ALDH1A1 (0.35) ALDH1A1MEN1KMT2AL3MBTL1SIGMAR1
SCHEMBL6547001 0.78 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ASIGMAR1TAAR1

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