SCHEMBL6008705

SCHEMBL6008705

BCc1cc(C#N)ccc1C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
MAPT P10636 3/20 0.40
RXFP1 Q9HBX9 2/20 0.40
MRGPRX4 Q96LA9 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK4 Q16654 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
NAMPT P43490 1/20 0.38
ALDH1A1 P00352 5/20 0.38
LMNA P02545 1/20 0.38
SETDB1 Q15047 1/20 0.38
HPGD P15428 3/20 0.38
GAA P10253 3/20 0.38

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
SCHEMBL286231 0.88 CYP2A6 (0.43) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL5955864 0.86 KDM4E (0.44) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL22072190 0.85 MRGPRX4 (0.43) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL22374270 0.85 KDM4E (0.41) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL4076913 0.85 ALDH1A1 (0.41) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL3819761 0.85 GAA (0.40) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL27335284 0.82 GSK3B (0.41) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL29758971 0.82 MRGPRX4 (0.39) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL17022230 0.82 MRGPRX4 (0.39) KDM4EMAPTRXFP1MRGPRX4CA12
SCHEMBL23457135 0.82 KDM4E (0.39) KDM4EMAPTRXFP1MRGPRX4CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220213056-A1 PROCESSES FOR PREPARING 2-(4-CHLOROPHENYL)-N-((2-(2,6-DIOXOPIPERIDIN-3-YL)-1-OXOISOINDOLIN-5-YL)METHYL)-2,2-DIFLUOROACETAMIDE CELGENE CORP (US) 2022-07-07 US disclosed
US-11312699-B2 Processes for preparing 2-(4-chlorophenyl)-N-((2-(2,6-dioxopiperidin-3-yl)-1-oxoisoindolin-5-yl)methyl)-2,2-difluoroacetamide CELGENE CORPORATION (US) 2022-04-26 US disclosed
US-20210171493-A1 PROCESSES FOR PREPARING 2-(4-CHLOROPHENYL)-N-((2-(2,6-DIOXOPIPERIDIN-3-YL)-1-OXOISOINDOLIN-5-YL)METHYL)-2,2-DIFLUOROACETAMIDE CELGENE CORPORATION 2021-06-10 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 (3 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-20210171493-A1 PROCESSES FOR PREPARING 2-(4-CHLOROPHENYL)-N-((2-(2,6-DIOXOPIPERIDIN-3-YL)-1-OXOISOINDOLIN-5-YL)METHYL)-2,2-DIFLUOROACETAMIDE DCPS, DNMT1, DPYD KDM4E 334/4885MAPT 2134/4885RXFP1 4832/4885
US-20220213056-A1 PROCESSES FOR PREPARING 2-(4-CHLOROPHENYL)-N-((2-(2,6-DIOXOPIPERIDIN-3-YL)-1-OXOISOINDOLIN-5-YL)METHYL)-2,2-DIFLUOROACETAMIDE DCPS, DNMT1, DPYD KDM4E 334/4885MAPT 2134/4885RXFP1 4832/4885
US-11312699-B2 Processes for preparing 2-(4-chlorophenyl)-N-((2-(2,6-dioxopiperidin-3-yl)-1-oxoisoindolin-5-yl)methyl)-2,2-difluoroacetamide DCPS, DNMT1, DPYD KDM4E 334/4885MAPT 2134/4885RXFP1 4832/4885

“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.