SCHEMBL15330710

SCHEMBL15330710

COCCn1cc(B(O)O)cn1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IKBKE Q14164 5/20 0.36
TBK1 Q9UHD2 5/20 0.36
KDM5B Q9UGL1 1/20 0.34
FEN1 P39748 1/20 0.34
LRRK2 Q5S007 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
JAK1 P23458 4/20 0.33
JAK3 P52333 4/20 0.33
JAK2 O60674 2/20 0.33
RET P07949 1/20 0.33
CDK2 P24941 1/20 0.33
GSK3B P49841 1/20 0.33
MERTK Q12866 1/20 0.33
PRKAA1 Q13131 1/20 0.33
ROCK1 Q13464 1/20 0.33
MAP3K5 Q99683 1/20 0.33
SYK P43405 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
SCHEMBL15331282 0.90 MAP3K5 (0.36) IKBKETBK1L3MBTL1JAK1JAK3
SCHEMBL31747882 0.82 CA1 (0.31)
SCHEMBL671710 0.80 L3MBTL1 (0.51) KDM5BL3MBTL1
SCHEMBL11931264 0.79 DUT (0.34)
SCHEMBL15663094 0.78 IKBKE (0.32) IKBKETBK1KDM5BLRRK2RET
SCHEMBL2551385 0.78 KIT (0.37) IKBKETBK1KDM5BFEN1L3MBTL1
SCHEMBL23227826 0.77 L3MBTL1 (0.41) L3MBTL1
SCHEMBL16101416 0.77 IKBKE (0.38) IKBKETBK1KDM5BFEN1LRRK2
SCHEMBL23227824 0.77 MAPT (0.33) L3MBTL1
SCHEMBL15334490 0.77 L3MBTL1 (0.33) FEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240245673-A1 Papain-like protease (PLpro) inhibitors PFIZER INC. (US) 2024-07-25 US disclosed
EP-3442974-B1 PYRAZOLOPYRIMIDINE DERIVATIVES BAYER ANIMAL HEALTH GMBH (DE) 2023-06-07 EP disclosed
CN-116063326-A Amino-containing macrocyclic compounds as protein kinase modulators 赛诺哈勃药业(成都)有限公司 2023-05-05 CN disclosed
EP-4143194-A1 CD73 INHIBITING 2,4-DIOXOPYRIMIDINE COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-03-08 EP disclosed
CN-115698009-A CD73 inhibiting 2,4-dioxopyrimidine compounds 吉利德科学公司 2023-02-03 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20180319793-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-11-08 US disclosed
US-9994562-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-06-12 US disclosed
EP-2970211-B1 HISTONE DEMETHYLASE INHIBITORS QUANTICEL PHARMACEUTICALS INC (US) 2017-07-26 EP disclosed
US-20160039808-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC 2016-02-11 US disclosed
EP-2970211-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals Inc (US) 2016-01-20 EP disclosed
WO-2014151106-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2014-09-25 WO disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 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-20180319793-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C IKBKE 742/4885TBK1 3303/4885KDM5B 6/4885
US-20160039808-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C IKBKE 742/4885TBK1 3303/4885KDM5B 6/4885
US-20240245673-A1 Papain-like protease (PLpro) inhibitors PREP, PEPD, ACE IKBKE 1368/4885TBK1 1703/4885KDM5B 3374/4885

“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.