SCHEMBL6547489

SCHEMBL6547489

C=C(Cc1ccccc1)c1ccccc1CCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.38
ADRB2 P07550 1/20 0.38
MAPT P10636 1/20 0.38
SCN1A P35498 3/20 0.38
SCN2A Q99250 3/20 0.38
SCN3A Q9NY46 3/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
FOLH1 Q04609 1/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
AKR1B1 P15121 1/20 0.36
KDR P35968 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 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
SCHEMBL6546320 0.87 HTT (0.45) HTTALDH1A1ADRB2MAPTSCN1A
SCHEMBL19291089 0.83 FOLH1 (0.36) HTTKMT2AALDH1A1LMNAFOLH1
SCHEMBL14062854 0.81 FOLH1 (0.41) HTTKMT2AALDH1A1ADRB2MAPT
SCHEMBL28449133 0.81 LMNA (0.49) HTTKMT2AALDH1A1ADRB2MAPT
SCHEMBL10957114 0.81 ALDH1A1 (0.42) HTTKMT2AALDH1A1LMNAFOLH1
SCHEMBL9311858 0.79 LIPG (0.40) HTTKMT2AALDH1A1KDM4ELMNA
SCHEMBL6548096 0.78 HTT (0.44) HTTKMT2AALDH1A1ADRB2SMN1; SMN2
SCHEMBL6546959 0.78 RXRA (0.43) HTTKMT2AALDH1A1MAPTLMNA
SCHEMBL7036783 0.77 MAPT (0.43) KMT2AALDH1A1ADRB2MAPTKDM4E
SCHEMBL712790 0.77 ALDH1A1 (0.40) HTTKMT2AALDH1A1KDM4ELMNA

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