SCHEMBL6547685

SCHEMBL6547685

C=C(c1ccccc1)c1ccccc1C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.47
ATM Q13315 2/20 0.47
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CA2 P00918 1/20 0.40
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
RBP4 P02753 1/20 0.35
ELANE P08246 1/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
CDC14B O60729 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
SCHEMBL4585848 0.84 MEN1 (0.43) TDP1ATMALDH1A1TSHRMEN1
SCHEMBL10599697 0.82 MEN1 (0.37) TDP1ATMALDH1A1MEN1KMT2A
SCHEMBL28567994 0.80 LMNA (0.47) LMNACDC14BEPM2APTPRCPTPN2
SCHEMBL10601315 0.78 GABRA1 (0.47) TDP1ATMALDH1A1TSHRCA2
SCHEMBL5694037 0.78 MEN1 (0.48) TDP1ATMALDH1A1TSHRMEN1
SCHEMBL713859 0.77 ALDH1A1 (0.48) TDP1ATMALDH1A1TSHRMEN1
SCHEMBL31031098 0.76 AKR1C3 (0.55) TDP1ATMALDH1A1TSHRMEN1
SCHEMBL10603046 0.76 CYP1A2 (0.49) TDP1ATMALDH1A1TSHRKMT2A
SCHEMBL2319763 0.76 AKR1C3 (0.55) TDP1ATMALDH1A1TSHRMEN1
SCHEMBL8362268 0.75 TDP1 (0.38) TDP1ATMALDH1A1TSHRMEN1

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 6 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
EP-0158809-B1 ELECTRICAL INSULATING OIL AND OIL-FILLED ELECTRICAL APPLIANCES NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-01-25 EP disclosed
US-4618914-A 1,1-DIARYLALKENES; HEAT RESISTANCE NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1986-10-21 US disclosed