SCHEMBL6546986

SCHEMBL6546986

CCc1ccccc1C(C)=Cc1ccccc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
HPGD P15428 3/20 0.38
LMNA P02545 3/20 0.38
HTT P42858 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SHBG P04278 1/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
PLIN1 O60240 1/20 0.35
POLB P06746 1/20 0.35
MAPT P10636 1/20 0.35
PLIN5 Q00G26 1/20 0.35
ABHD5 Q8WTS1 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
CLCN2 P51788 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
SCHEMBL6546613 0.82 ALDH1A1 (0.45) ALDH1A1TSHRHPGDLMNAHTT
SCHEMBL6120361 0.77 MEN1 (0.47) ALDH1A1TSHRLMNAHTTL3MBTL1
SCHEMBL6546872 0.77 MEN1 (0.47) ALDH1A1TSHRLMNAHTTL3MBTL1
SCHEMBL27876011 0.76 GABRA1 (0.43) ALDH1A1TSHRLMNAHTTKDM4E
SCHEMBL2160485 0.75 ALDH1A1 (0.38) ALDH1A1TSHRHPGDLMNAHTT
SCHEMBL6547236 0.73 KDM4E (0.42) ALDH1A1HPGDLMNAHTTMEN1
SCHEMBL27491795 0.72 ALDH1A1 (0.46) ALDH1A1TSHRHPGDLMNAHTT
SCHEMBL22597894 0.72 ALDH1A1 (0.46) ALDH1A1TSHRHPGDLMNAHTT
SCHEMBL16857588 0.72 GABRA1 (0.39) ALDH1A1HPGDLMNAHTTL3MBTL1
SCHEMBL6546762 0.71 NFE2L2 (0.43) ALDH1A1TSHRHPGDLMNAHTT

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