SCHEMBL6546483

SCHEMBL6546483

CCCc1ccccc1C(C)=Cc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NISCH Q9Y2I1 1/20 0.41
ALDH1A1 P00352 2/20 0.39
TSHR P16473 2/20 0.39
AKR1C3 P42330 1/20 0.39
LMNA P02545 3/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
BRD4 O60885 1/20 0.36
CREBBP Q92793 1/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
FBP1 P09467 1/20 0.36

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
SCHEMBL6546466 1.00 MEN1 (0.41) MEN1KMT2ANISCHALDH1A1TSHR
SCHEMBL6120361 0.86 MEN1 (0.47) MEN1KMT2ANISCHALDH1A1TSHR
SCHEMBL6546872 0.86 MEN1 (0.47) MEN1KMT2ANISCHALDH1A1TSHR
SCHEMBL7715071 0.79 TSHR (0.52) MEN1KMT2ANISCHALDH1A1TSHR
SCHEMBL6546471 0.77 MEN1 (0.46) MEN1KMT2AALDH1A1TSHRAKR1C3
SCHEMBL28329261 0.76 ALDH1A1 (0.38) KMT2AALDH1A1LMNAHTTCYP3A4
SCHEMBL9046425 0.75 ALDH1A1 (0.42) KMT2AALDH1A1LMNAHTTFOLH1
SCHEMBL18378183 0.75 ALDH1A1 (0.42) KMT2AALDH1A1LMNAHTTFOLH1
SCHEMBL23367957 0.75 LMNA (0.34) ALDH1A1LMNAHTTCYP3A4CYP2D6
SCHEMBL2491587 0.73 FOLH1 (0.41) KMT2AALDH1A1TSHRLMNAHTT

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