SCHEMBL6547477

SCHEMBL6547477

CCC(C)c1ccccc1Cc1ccc(C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
STAT3 P40763 1/20 0.35
HTT P42858 1/20 0.35
KCNH2 Q12809 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC5A2 P31639 2/20 0.35
KEAP1 Q14145 1/20 0.34
HTR2A P28223 1/20 0.34
SLC6A4 P31645 1/20 0.34

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
SCHEMBL5664115 0.87 TSHR (0.52) TSHRPOLBHTR2AL3MBTL1ATM
SCHEMBL9621605 0.84 SMN1; SMN2 (0.39) TSHRSMN1; SMN2POLBMEN1KMT2A
SCHEMBL6546906 0.84 CNR2 (0.39) TSHRSMN1; SMN2POLBSLC5A2KEAP1
SCHEMBL6547484 0.82 TSHR (0.50) TSHRKMT2AALDH1A1HPGD
SCHEMBL23457325 0.81 SMN1; SMN2 (0.37) TSHRSMN1; SMN2POLBSLC5A2KEAP1
SCHEMBL6547495 0.78 TSHR (0.46) TSHRHTR2ASLC6A4L3MBTL1ATM
SCHEMBL9403954 0.77 SLC6A2 (0.47) TSHRPOLBLMNAALOX12TDP1
SCHEMBL9838740 0.75 TSHR (0.59) TSHRHTTSLC6A4L3MBTL1ATM
SCHEMBL3627333 0.75 TSHR (0.59) TSHRMAPTHTTKCNH2NPSR1
SCHEMBL5353085 0.74 TSHR (0.57) TSHRHTTL3MBTL1ATM

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