SCHEMBL20415397

SCHEMBL20415397

CCOC(=O)/C=C/CNC1CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
HCAR2 Q8TDS4 1/20 0.44
ALDH1A1 P00352 4/20 0.41
LMNA P02545 4/20 0.36
TTR P02766 1/20 0.36
DPP4 P27487 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
NPSR1 Q6W5P4 3/20 0.35
MDM2 Q00987 1/20 0.35
CYP3A4 P08684 1/20 0.35
THRB P10828 2/20 0.35
TP53 P04637 1/20 0.35
XBP1 P17861 1/20 0.35
MAPK1 P28482 1/20 0.35
AGTR1 P30556 1/20 0.35

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
SCHEMBL14617840 0.84 HCAR2 (0.44) HCAR2TTRCA12CA1CA2
SCHEMBL30037818 0.80 HCAR2 (0.38) HCAR2
SCHEMBL14693491 0.77 HCAR2 (0.41) HCAR2NPSR1L3MBTL1
SCHEMBL14693492 0.77 HCAR2 (0.41) HCAR2NPSR1L3MBTL1
SCHEMBL17426067 0.77 ALDH1A1 (0.33) MAPTALDH1A1CYP3A4POLB
SCHEMBL20261888 0.76 NPSR1 (0.42) HCAR2LMNANPSR1HTTSMN1; SMN2
SCHEMBL10181124 0.76 NPSR1 (0.42) HCAR2LMNANPSR1HTTSMN1; SMN2
SCHEMBL11805646 0.76 HCAR2 (0.52) MAPTHCAR2ALDH1A1LMNATTR
SCHEMBL18909623 0.76 HTR2A (0.34) POLB
SCHEMBL7609837 0.76 HCAR2 (0.52) MAPTHCAR2ALDH1A1LMNATTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10793576-B2 Compound used as Bruton's tyrosine kinase inhibitor and preparation method and application thereof CHENGDU BRILLIANT PHARMACEUTICAL CO., LTD. (CN) 2020-10-06 US disclosed
US-10793576-B2 Compound used as Bruton's tyrosine kinase inhibitor and preparation method and application thereof CHENGDU BRILLIANT PHARMACEUTICAL CO., LTD. (CN) 2020-10-06 US disclosed
US-20190315758-A1 COMPOUND USED AS BRUTON'S TYROSINE KINASE INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF CHENGDU BRILLIANT PHARMACEUTICAL CO., LTD. (CN) 2019-10-17 US disclosed
US-20190315758-A1 COMPOUND USED AS BRUTON'S TYROSINE KINASE INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF CHENGDU BRILLIANT PHARMACEUTICAL CO., LTD. (CN) 2019-10-17 US disclosed
WO-2018133151-A1 COMPOUND USED AS BRUTON'S TYROSINE KINASE INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF 成都倍特药业有限公司 2018-07-26 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 (2 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-20190315758-A1 COMPOUND USED AS BRUTON'S TYROSINE KINASE INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF BTK, SYK, LYN MAPT 4186/4885HCAR2 4552/4885ALDH1A1 4326/4885
US-10793576-B2 Compound used as Bruton's tyrosine kinase inhibitor and preparation method and application thereof BTK, SYK, LYN MAPT 4186/4885HCAR2 4552/4885ALDH1A1 4326/4885

“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.