SCHEMBL1777152

SCHEMBL1777152

[c]1c(C2CCCCC2)cccc1C1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CEL P19835 2/20 0.38
CYP11B2 P19099 1/20 0.38
KMO O15229 1/20 0.37
POLB P06746 1/20 0.35
CASP3 P42574 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
HDAC4 P56524 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
PTPN1 P18031 2/20 0.33
PTPRC P08575 1/20 0.33
PTPRF P10586 1/20 0.33
CDC25B P30305 1/20 0.33
ABCB1 P08183 1/20 0.32
SLC18A3 Q16572 1/20 0.31
HTR1A P08908 1/20 0.31
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
HTR7 P34969 1/20 0.31

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
SCHEMBL21777712 0.97 CEL (0.36) CELCYP11B2KMOPOLBCASP3
SCHEMBL17710524 0.92 CEL (0.32) CELCYP11B2KMOHDAC4HDAC2
SCHEMBL16752251 0.87 AKR1C3 (0.31)
SCHEMBL1776322 0.85 CEL (0.33) CELCYP11B2KMOPOLBCASP3
SCHEMBL4886658 0.82 CEL (0.32) CELKMOCASP3SENP7SENP6
SCHEMBL1778508 0.82 CEL (0.32) CELCYP11B2KMO
SCHEMBL1776833 0.82 PTPN1 (0.34) CELCYP11B2KMOPTPN1PTPRC
SCHEMBL6285498 0.80 CASP3 (0.41) CELKMOPOLBCASP3SENP7
SCHEMBL1777508 0.80 HTR1A (0.31) CELCYP11B2KMOHTR1ADRD2
SCHEMBL7949502 0.78 POLB (0.30) POLBCASP3SENP7SENP6

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 173 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE U.S.A., AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2024-07-04 US claimed
CN-117551134-A Complex and preparation method and application thereof 南京佳诺霖光电科技有限公司 2024-02-13 CN claimed
WO-2024022413-A1 DIVALENT METAL COMPLEX, PREPARATION METHOD THEREFOR AND USE THEREOF, AND ORGANIC OPTOELECTRONIC DEVICE 中国石油化工股份有限公司 2024-02-01 WO claimed
CN-117466944-A Divalent metal complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2024-01-30 CN claimed
WO-2023196594-A2 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-10-12 WO claimed
CN-116574136-A Bivalent platinum complex and preparation method and application thereof 南京佳诺霖光电科技有限公司 2023-08-11 CN claimed
CN-115991724-A Blue phosphorescence bivalent platinum complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2023-04-21 CN claimed
CN-115991725-A Green phosphorescence bivalent platinum complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2023-04-21 CN claimed
CN-115991722-A Yellow-green phosphorescence bivalent platinum complex, preparation method and application thereof, and organic photoelectric device 中国石油化工股份有限公司 2023-04-21 CN claimed
CN-115700254-A Bivalent platinum complex and preparation method and application thereof 南京工业大学 2023-02-07 CN claimed
US-20190177449-A1 Quinolinyldiamido Transition Metal Complexes, Production and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2019-06-13 US claimed
EP-3478694-A1 QUINOLINYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF ExxonMobil Chemical Patents Inc. (US) 2019-05-08 EP claimed
US-10208140-B2 Quinolinyldiamido transition metal complexes, production and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-02-19 US claimed
US-20180319907-A1 Long Chain Branched Polypropylene Via Polymerization with Aluminum Vinyl Transfer Agent EXXONMOBIL CHEMICAL PATENTS INC. 2018-11-08 US claimed
WO-2018160276-A1 POLYMERS PRODUCED VIA USE OF QUINOLINYLDIAMIDO TRANSITION METAL COMPLEXES AND VINYL TRANSFER AGENTS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-09-07 WO claimed
US-20180134816-A1 Polymers Produced via Use of Quinolinyldiamido Transition Metal Complexes and Vinyl Transfer Agents EXXONMOBIL CHEMICAL PATENTS INC. 2018-05-17 US claimed
US-20180002352-A1 Quinolinyldiamido Transition Metal Complexes, Production and Use Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2018-01-04 US claimed
WO-2018005201-A1 QUINOLINYLDIAMIDO TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-01-04 WO claimed
US-5530162-A Process for the hydrogenation of aryl phosphines and products obtained therefrom RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1996-06-25 US claimed
WO-1993021192-A1 PROCESS FOR THE HYDROGENATION OF ARYL PHOSPHINES AND PRODUCTS OBTTAINED THEREFROM RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-10-28 WO claimed

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

For each of this compound's patents that has machine-readable text (4 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-20240216900-A1 SABRE CATALYSTS CONTAINING FLUORINATED CARBON CHAINS FOR DELIVERY OF METAL-FREE MRI CONTRAST AGENTS FABP7, FFAR1, FABP1 CEL 362/4885CYP11B2 1280/4885KMO 1409/4885
US-10208140-B2 Quinolinyldiamido transition metal complexes, production and use thereof PARN, PARG, PICALM CEL 4717/4885CYP11B2 3657/4885KMO 344/4885
US-20180002352-A1 Quinolinyldiamido Transition Metal Complexes, Production and Use Thereof PARN, PARG, PICALM CEL 4717/4885CYP11B2 3657/4885KMO 344/4885
US-20190177449-A1 Quinolinyldiamido Transition Metal Complexes, Production and Use Thereof PARN, PARG, PICALM CEL 4717/4885CYP11B2 3657/4885KMO 344/4885

“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.