SCHEMBL7198503

SCHEMBL7198503

C=CCc1c(C)ccc2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
CYP1A2 P05177 4/20 0.48
CYP2A6 P11509 3/20 0.48
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 3/20 0.41
HSD17B10 Q99714 3/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
IMPDH2 P12268 1/20 0.38
HPGD P15428 1/20 0.38
GAA P10253 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
KMT2A Q03164 1/20 0.37
HPRT1 P00492 1/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 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
SCHEMBL28437237 0.82 TSHR (0.46) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL253635 0.79 HSD17B10 (0.41) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL6893951 0.79 HSD17B10 (0.38) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL7192189 0.79 NCEH1 (0.40) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL7195959 0.79 CYP1A2 (0.40) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL821213 0.79 TSHR (0.54) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL6249203 0.78 TSHR (0.58) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL16042478 0.78 TSHR (0.58) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL8637918 0.78 HSD17B10 (0.40) TSHRCYP1A2CYP2A6KDM4EALDH1A1
SCHEMBL2162162 0.78 IMPDH2 (0.61) TSHRCYP1A2CYP2A6KDM4EALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102061186-B Crude oil enhanced distillation agent and preparation method thereof BEIJING DILI WEIYE SCIENCE AND TECHNOLOGY DEV CO LTD 2013-03-20 CN claimed
CN-102061186-A Crude oil enhanced distillation agent and preparation method thereof BEIJING ALBERT DILI SCIENCE AND TECHNOLOGY DEV CO LTD 2011-05-18 CN claimed
JP-10053786-A None JP disclosed
JP-10017880-A None JP disclosed
CN-108440233-B Method for continuously extracting beta-methylnaphthalene crude product from methylnaphthalene enrichment solution 鹏辰新材料科技股份有限公司 2021-02-05 CN disclosed
CN-102061186-B Crude oil enhanced distillation agent and preparation method thereof BEIJING DILI WEIYE SCIENCE AND TECHNOLOGY DEV CO LTD 2013-03-20 CN disclosed
CN-102061186-A Crude oil enhanced distillation agent and preparation method thereof BEIJING ALBERT DILI SCIENCE AND TECHNOLOGY DEV CO LTD 2011-05-18 CN disclosed
US-6534595-B2 Blend of thermosetting resin, decomposable resin and solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-18 US disclosed
US-20010038887-A1 Coating solution for forming porous organic film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-08 US disclosed
JP-H1053786-A SYNTHETIC LUBRICATING OIL COMPOSITION NKK CORP 1998-02-24 JP disclosed
JP-H1017880-A LUBRICATING OIL COMPOSITION EXCELLENT IN HYDROLYTIC STABILITY NKK CORP 1998-01-20 JP disclosed