SCHEMBL18878452

SCHEMBL18878452

CC(C)=C1CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ESR2 Q92731 1/20 0.42
ADORA1 P30542 1/20 0.41
NR1H2 P55055 4/20 0.41
MAPK1 P28482 1/20 0.41
HPGD P15428 1/20 0.40
HDAC1 Q13547 1/20 0.40
GPR119 Q8TDV5 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL17330351 0.85 USP2 (0.44) USP2SMN1; SMN2ESR2NR1H2MAPK1
SCHEMBL22421425 0.85 USP2 (0.44) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL17330354 0.82 USP2 (0.46) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL20621454 0.82 USP2 (0.42) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL2292608 0.81 USP2 (0.52) USP2SMN1; SMN2ESR2NR1H2MAPK1
SCHEMBL24817011 0.81 USP2 (0.53) USP2SMN1; SMN2ESR2ADORA1NR1H2
SCHEMBL18975935 0.80 USP2 (0.41) USP2SMN1; SMN2ESR2NR1H2MAPK1
SCHEMBL13801225 0.79 USP2 (0.50) USP2SMN1; SMN2ESR2NR1H2MAPK1
SCHEMBL120243 0.79 USP2 (0.50) USP2SMN1; SMN2ESR2NR1H2MAPK1
SCHEMBL17080478 0.79 USP2 (0.50) USP2SMN1; SMN2ESR2NR1H2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236082-B2 EZH2 inhibitors and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-02-01 US disclosed
US-20200338074-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-10-29 US disclosed
US-10702527-B2 Combination therapy of transcription inhibitors and kinase inhibitors DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-07-07 US disclosed
US-10308653-B2 Diazepane derivatives and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-06-04 US disclosed
US-20190015411-A9 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-01-17 US disclosed
US-20190000860-A1 USE OF COMPOSITIONS MODULATING CHROMATIN STRUCTURE FOR GRAFT VERSUS HOST DISEASE (GVHD) DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-01-03 US disclosed
US-20180169097-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-06-21 US disclosed
US-20180169097-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-06-21 US disclosed
US-9951074-B2 Dihydropteridinone derivatives and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-04-24 US disclosed
US-9951074-B2 Dihydropteridinone derivatives and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2018-04-24 US disclosed
US-20170145023-A1 DIAZEPANE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 US disclosed
US-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 US disclosed
US-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2017-05-25 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 (9 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-20190000860-A1 USE OF COMPOSITIONS MODULATING CHROMATIN STRUCTURE FOR GRAFT VERSUS HOST DISEASE (GVHD) BCL6, BCL6B, EZH2 USP2 2227/4885SMN1; SMN2 3797/4885ESR2 2750/4885
US-10308653-B2 Diazepane derivatives and uses thereof BRDT, BRD4, BAZ2A USP2 2901/4885SMN1; SMN2 4335/4885ESR2 41/4885
US-10702527-B2 Combination therapy of transcription inhibitors and kinase inhibitors CHUK, BCOR, MYC USP2 1935/4885SMN1; SMN2 2995/4885ESR2 871/4885
US-20180169097-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS CHUK, BCOR, MYC USP2 1935/4885SMN1; SMN2 2995/4885ESR2 871/4885
US-20190015411-A9 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS CHUK, BCOR, MYC USP2 1935/4885SMN1; SMN2 2995/4885ESR2 871/4885
US-20170145013-A1 DIHYDROPTERIDINONE DERIVATIVES AND USES THEREOF BRDT, BRD4, BRD3 USP2 3914/4885SMN1; SMN2 4517/4885ESR2 63/4885
US-11236082-B2 EZH2 inhibitors and uses thereof EZH2, EZH1, BMI1 USP2 877/4885SMN1; SMN2 2805/4885ESR2 465/4885
US-20200338074-A1 COMBINATION THERAPY OF TRANSCRIPTION INHIBITORS AND KINASE INHIBITORS CHUK, BCOR, MYC USP2 1935/4885SMN1; SMN2 2995/4885ESR2 871/4885
US-20170145023-A1 DIAZEPANE DERIVATIVES AND USES THEREOF BRDT, BRD4, BAZ2A USP2 2901/4885SMN1; SMN2 4335/4885ESR2 41/4885

“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.