SCHEMBL5953553

SCHEMBL5953553

CCCc1ccc(C[Mg]Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.45
LIPG Q9Y5X9 2/20 0.45
MGLL Q99685 1/20 0.44
CA2 P00918 1/20 0.42
PLK1 P53350 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
POLB P06746 2/20 0.39
CTDSP1 Q9GZU7 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
CNR2 P34972 2/20 0.39
HTR2A P28223 1/20 0.39
CNR1 P21554 1/20 0.39
THRB P10828 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
NISCH Q9Y2I1 1/20 0.35
HTR1D P28221 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
SCHEMBL1445944 0.86 HTR2A (0.50) LPLLIPGMGLLCA2PLK1
SCHEMBL10317372 0.85 HTR2A (0.59) LPLLIPGMGLLCA2KDM4E
SCHEMBL10318229 0.83 HTR2A (0.62) LPLLIPGMGLLKDM4EALDH1A1
SCHEMBL10319579 0.83 HTR2A (0.62) LPLLIPGMGLLKDM4EALDH1A1
SCHEMBL10318692 0.83 HTR2A (0.62) LPLLIPGMGLLKDM4EALDH1A1
SCHEMBL10321280 0.83 HTR2A (0.62) LPLLIPGMGLLKDM4EALDH1A1
SCHEMBL10317849 0.83 HTR2A (0.62) LPLLIPGMGLLKDM4EALDH1A1
SCHEMBL558967 0.80 TAAR1 (0.48) LPLLIPGMGLLCA2PLK1
SCHEMBL142480 0.79 LPL (0.62) LPLLIPGMGLLCA2PLK1
SCHEMBL5247951 0.79 GRIN2D (0.40) LPLLIPGTAAR1CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114437294-B Surface active polymer, preparation method thereof and application of surface active polymer as polymer oil displacement agent 中国石油化工股份有限公司 2023-04-11 CN disclosed
CN-114437294-A Surface active polymer, preparation method thereof and application of surface active polymer as polymer oil displacement agent 中国石油化工股份有限公司 2022-05-06 CN disclosed
US-9919300-B2 1-hexene production process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-03-20 US disclosed
EP-2484685-B1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND SUMITOMO CHEMICAL CO (JP) 2017-11-01 EP disclosed
US-20170036200-A1 1-HEXENE PRODUCTION PROCESS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-09 US disclosed
US-20150105572-A1 TRANSITION METAL COMPLEX SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-16 US disclosed
US-20150105237-A1 CATALYTIC COMPONENT FOR TRIMERIZATION AND TRIMERIZATION CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-04-16 US disclosed
EP-2484685-A1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND Sumitomo Chemical Co., Ltd (JP) 2012-08-08 EP disclosed
US-20120184431-A1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-19 US disclosed
US-20060052620-A1 Preparation of substituted indenes BASELL POLYOLEFINE GMBH (DE) 2006-03-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170036200-A1 1-HEXENE PRODUCTION PROCESS AP1M1, HK1, CYC1 LPL 3159/4885LIPG 3339/4885MGLL 2180/4885
US-20150105572-A1 TRANSITION METAL COMPLEX AP1M1, AP3M1, EMC1 LPL 3662/4885LIPG 3502/4885MGLL 2034/4885
US-20150105237-A1 CATALYTIC COMPONENT FOR TRIMERIZATION AND TRIMERIZATION CATALYST AP1M1, AMY1A, AP3M1 LPL 1958/4885LIPG 2211/4885MGLL 910/4885
US-20060052620-A1 Preparation of substituted indenes INTS9, CYP1A2, INF2 LPL 4104/4885LIPG 4647/4885MGLL 2090/4885
US-20120184431-A1 TRANSITION METAL COMPLEX, PREPARATION METHOD FOR SAID TRANSITION METAL COMPLEX, TRIMERIZATION CATALYST, PREPARATION METHOD FOR 1-HEXENE, PREPARATION METHOD FOR ETHYLENE POLYMER, SUBSTITUTED CYCLOPENTADIENE COMPOUND, AND PREPARATION METHOD FOR SAID SUBSTITUTED CYCLOPENTADIENE COMPOUND EMC1, CYC1, AP1M1 LPL 3836/4885LIPG 3832/4885MGLL 2286/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.