SCHEMBL14617834

SCHEMBL14617834

COCCN(C)C/C=C/C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
PIK3CD O00329 1/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
FGFR2 P21802 1/20 0.31
TTR P02766 1/20 0.30
APP P05067 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL15156210 1.00 HCAR2 (0.41) HCAR2KEAP1NFE2L2PIK3CDEGFR
SCHEMBL14165483 0.84 PIK3CD (0.38) PIK3CDEGFRERBB2MEN1KMT2A
SCHEMBL30623012 0.84 HCAR2 (0.43) HCAR2KEAP1NFE2L2EGFRERBB2
SCHEMBL2842616 0.84 PIK3CD (0.38) HCAR2PIK3CDEGFRERBB2MEN1
SCHEMBL2842621 0.84 PIK3CD (0.38) HCAR2PIK3CDEGFRERBB2MEN1
SCHEMBL14165482 0.84 PIK3CD (0.38) PIK3CDEGFRERBB2MEN1KMT2A
SCHEMBL15709423 0.84 HCAR2 (0.43) HCAR2KEAP1NFE2L2MEN1KMT2A
SCHEMBL15709422 0.84 HCAR2 (0.43) HCAR2KEAP1NFE2L2MEN1KMT2A
SCHEMBL30325383 0.83 HCAR2 (0.36) HCAR2KEAP1NFE2L2MEN1KMT2A
SCHEMBL30380106 0.83 HCAR2 (0.36) HCAR2KEAP1NFE2L2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116157388-A Carbocyclic amide derivative and application thereof in medicine 四川海思科制药有限公司 2023-05-23 CN disclosed
WO-2022053000-A1 CARBOCYCLIC AMIDE DERIVATIVE AND APPLICATION THEREOF IN MEDICINE 四川海思科制药有限公司 2022-03-17 WO disclosed
US-9862722-B2 Inhibitors of Bruton's tyrosine kinase PHARMACYCLICS LLC (US) 2018-01-09 US disclosed
EP-3147285-A2 PURINONE COMPOUNDS AS KINASE INHIBITORS Pharmacyclics, Inc. (US) 2017-03-29 EP disclosed
EP-3147285-A2 PURINONE COMPOUNDS AS KINASE INHIBITORS Pharmacyclics, Inc. (US) 2017-03-29 EP disclosed
US-20160368924-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. 2016-12-22 US disclosed
US-20160368924-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. 2016-12-22 US disclosed
US-20160368924-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. 2016-12-22 US disclosed
US-9469642-B2 Purinone compounds as kinase inhibitors PHARMACYCLICS LLC (US) 2016-10-18 US disclosed
US-9469642-B2 Purinone compounds as kinase inhibitors PHARMACYCLICS LLC (US) 2016-10-18 US disclosed
US-9138436-B2 Inhibitors of Bruton's tyrosine kinase PHARMACYCLICS LLC (US) 2015-09-22 US disclosed
US-9138436-B2 Inhibitors of Bruton's tyrosine kinase PHARMACYCLICS LLC (US) 2015-09-22 US disclosed
US-20140378446-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. (US) 2014-12-25 US disclosed
US-20140378446-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. (US) 2014-12-25 US disclosed
US-20140378446-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. (US) 2014-12-25 US disclosed
EP-2809672-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS Pharmacyclics, Inc. (US) 2014-12-10 EP disclosed
WO-2013116382-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS PHARMACYCLICS, INC. (US) 2013-08-08 WO disclosed
US-20130018032-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS, INC. (US) 2013-01-17 US disclosed
WO-2013010136-A2 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS, INC. (US) 2013-01-17 WO disclosed
US-20130018032-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE PHARMACYCLICS, INC. (US) 2013-01-17 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-20160368924-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS BTK, LCK, BCL9 HCAR2 4156/4885KEAP1 2988/4885NFE2L2 3479/4885
US-20130018032-A1 INHIBITORS OF BRUTON'S TYROSINE KINASE ABL1, BTK, ABL2 HCAR2 4580/4885KEAP1 3166/4885NFE2L2 4376/4885
US-20140378446-A1 PURINONE COMPOUNDS AS KINASE INHIBITORS BTK, LCK, BCL9 HCAR2 4156/4885KEAP1 2988/4885NFE2L2 3479/4885

“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.