SCHEMBL16462298

SCHEMBL16462298

COc1cc(C#N)c(C2COC(=O)O2)cc1OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.40
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.34
USP2 O75604 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KCNJ1 P48048 4/20 0.33
KCNH2 Q12809 1/20 0.33
LMNA P02545 1/20 0.33
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP19A1 P11511 1/20 0.32
AR P10275 1/20 0.32
PDE4B Q07343 1/20 0.32
ESRRA P11474 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL16464388 0.72 CYP19A1 (0.50) HTR2AALDH1A1KDM4EUSP2MEN1
SCHEMBL16466000 0.69 PTAFR (0.56) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL4258349 0.67 ALDH1A1 (0.59) ALDH1A1KDM4EUSP2ARPDE4B
SCHEMBL5882385 0.66 HTR2A (0.39) HTR2AALDH1A1KDM4EUSP2MEN1
SCHEMBL286724 0.65 HTR2A (0.44) HTR2AALDH1A1KDM4EUSP2KCNJ1
SCHEMBL296732 0.64 HTR2A (0.43) HTR2AALDH1A1KDM4EUSP2KCNJ1
SCHEMBL286729 0.64 KCNJ1 (0.43) HTR2AALDH1A1KDM4EUSP2KCNJ1
SCHEMBL1343373 0.63 ALDH1A1 (0.55) HTR2AALDH1A1KDM4EUSP2AR
SCHEMBL2761994 0.63 ALDH1A1 (0.59) HTR2AALDH1A1KDM4EUSP2AR
SCHEMBL5959243 0.62 MAOB (0.49) SMN1; SMN2CYP3A4CYP19A1ARMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2903974-B1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENT & IND RES AN INDIAN REGISTERED BODY INC UNDER THE REGISTRATION OF SOCIETIES ACT AC (IN) 2016-11-23 EP claimed
US-9266854-B2 One step process for synthesis of cyclic carbonates COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-02-23 US claimed
US-20150259318-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-17 US claimed
EP-2903974-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES Council of Scientific & Industrial Research An Indian registered body incorporated under the Registration of Societies Act (Act XXI of 1860) (IN) 2015-08-12 EP claimed
WO-2014057500-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED (IN) 2014-04-17 WO claimed
EP-2903974-B1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENT & IND RES AN INDIAN REGISTERED BODY INC UNDER THE REGISTRATION OF SOCIETIES ACT AC (IN) 2016-11-23 EP disclosed
EP-2903974-B1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENT & IND RES AN INDIAN REGISTERED BODY INC UNDER THE REGISTRATION OF SOCIETIES ACT AC (IN) 2016-11-23 EP disclosed
US-9266854-B2 One step process for synthesis of cyclic carbonates COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2016-02-23 US disclosed
US-20150259318-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-17 US disclosed
US-20150259318-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-17 US disclosed
US-20150259318-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-09-17 US disclosed
EP-2903974-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES Council of Scientific & Industrial Research An Indian registered body incorporated under the Registration of Societies Act (Act XXI of 1860) (IN) 2015-08-12 EP disclosed
US-8940748-B2 Iminothiadiazine dioxide compounds as BACE inhibitors, compositions, and their use MERCK SHARP & DOHME CORP. (US) 2015-01-27 US disclosed
WO-2014057500-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH AN INDIAN REGISTERED BODY INCORPORATED (IN) 2014-04-17 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-20150259318-A1 ONE STEP PROCESS FOR SYNTHESIS OF CYCLIC CARBONATES CDY1; CDY1B, CA4, CCNY HTR2A 3310/4885NPSR1 2639/4885ALDH1A1 858/4885

“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.