SCHEMBL6676887

SCHEMBL6676887

O=C(CCOc1cccc2ccccc12)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.59
ALDH1A1 P00352 3/20 0.59
HPGD P15428 3/20 0.59
TDP1 Q9NUW8 1/20 0.59
MRGPRX4 Q96LA9 1/20 0.56
KCNA3 P22001 1/20 0.55
HTR1B P28222 5/20 0.54
MCL1 Q07820 6/20 0.52
ATM Q13315 1/20 0.51
HTR1D P28221 2/20 0.50
OGG1 O15527 1/20 0.50
DAPK1 P53355 1/20 0.50
PIM3 Q86V86 1/20 0.50
BCL2 P10415 2/20 0.49
BCL2L1 Q07817 2/20 0.49
BAD Q92934 2/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL30600098 1.00 KDM4E (0.59) KDM4EALDH1A1HPGDTDP1MRGPRX4
SCHEMBL29865765 0.85 KDM4E (0.70) KDM4EALDH1A1HPGDTDP1MRGPRX4
SCHEMBL2925236 0.85 KDM4E (0.70) KDM4EALDH1A1HPGDTDP1MRGPRX4
SCHEMBL6224144 0.84 ALDH1A1 (0.73) KDM4EALDH1A1HPGDTDP1MRGPRX4
SCHEMBL4902115 0.82 KDM4E (0.60) KDM4EALDH1A1HPGDTDP1KCNA3
SCHEMBL2925774 0.81 HTR1B (0.62) KDM4EALDH1A1HPGDTDP1KCNA3
SCHEMBL29865493 0.81 KDM4E (0.68) KDM4EALDH1A1HPGDTDP1KCNA3
SCHEMBL5488944 0.81 KDM4E (0.68) KDM4EALDH1A1HPGDTDP1KCNA3
SCHEMBL6331711 0.81 KDM4E (0.58) KDM4EALDH1A1HPGDTDP1KCNA3
SCHEMBL7278832 0.81 KDM4E (0.66) KDM4EALDH1A1HPGDTDP1KCNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117451880-A Method for measuring dapoxetine hydrochloride impurity by using supercritical fluid chromatography 海南卓力制药有限公司 2024-01-26 CN claimed
CN-116715593-A Optimized preparation method of dapoxetine hydrochloride and intermediate thereof 北京悦康科创医药科技股份有限公司 2023-09-08 CN claimed
CN-117705964-A Dapoxetine hydrochloride and analysis method of preparation thereof 武汉九珑人福药业有限责任公司 2024-03-15 CN disclosed
CN-117451880-A Method for measuring dapoxetine hydrochloride impurity by using supercritical fluid chromatography 海南卓力制药有限公司 2024-01-26 CN disclosed
US-11802274-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2023-10-31 US disclosed
US-11802274-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2023-10-31 US disclosed
US-20230295673-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2023-09-21 US disclosed
US-20230295673-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2023-09-21 US disclosed
CN-116715593-A Optimized preparation method of dapoxetine hydrochloride and intermediate thereof 北京悦康科创医药科技股份有限公司 2023-09-08 CN disclosed
US-20220315961-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2022-10-06 US disclosed
US-11377673-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds CODEXIS, INC. (US) 2022-07-05 US disclosed
WO-2015073555-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS CODEXIS, INC. (US) 2015-05-21 WO disclosed
US-20150132807-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2015-05-14 US disclosed
US-20150132807-A1 ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS INNOVATUS LIFE SCIENCES LENDING FUND I, LP, AS COLLATERAL AGENT 2015-05-14 US disclosed
US-20130302859-A1 Engineered imine reductases and methods for the reductive animation of ketone and amine compounds. CODEXIS,INC. (US) 2013-11-14 US disclosed
US-20130302859-A1 Engineered imine reductases and methods for the reductive animation of ketone and amine compounds. CODEXIS,INC. (US) 2013-11-14 US disclosed
US-6806378-B2 CATALYST SYSTEM AND A PROCESS FOR THE PREPARATION OF A NONRACEMIC CHIRAL ALCOHOL BY HYDROGENATION OF A KETONE USING THE CATALYST SYSTEM, WHEREIN THE CATALYST SYSTEM COMPRISES RUTHENIUM, A NONRACEMIC CHIRAL DIPHOSPHINE LIGAND, AN DSM N.V. (NL) 2004-10-19 US disclosed
EP-1465726-A1 PROCESS FOR PREPARING NONRACEMIC CHIRAL ALCOHOLS DSM IP Assets B.V. (NL) 2004-10-13 EP disclosed
US-20030171213-A1 Process for preparing nonracemic chiral alcohols DSM N.V. (NL) 2003-09-11 US disclosed
WO-2003061824-A1 PROCESS FOR PREPARING NONRACEMIC CHIRAL ALCOHOLS DSM IP ASSETS B.V. (NL) 2003-07-31 WO 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 (1 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-11802274-B2 Engineered imine reductases and methods for the reductive amination of ketone and amine compounds AKR1C4, AKR7A2, AKR1C2 KDM4E 1354/4885ALDH1A1 162/4885HPGD 216/4885

“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.