SCHEMBL2700407

SCHEMBL2700407

Cc1cccc(-c2ccc(B(O)O)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 2/20 0.59
▸ CA2 P00918 2/20 0.59
▸ CA1 P00915 1/20 0.59
▸ LPL P06858 1/20 0.52
▸ LIPG Q9Y5X9 1/20 0.52
▸ HSD17B1 P14061 2/20 0.45
▸ HSD17B2 P37059 2/20 0.45
▸ ENPP3 O14638 1/20 0.45
▸ ACHE P22303 3/20 0.42
▸ PGR P06401 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CTDSP1 Q9GZU7 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ PTPN5 P54829 1/20 0.40
▸ TRPV1 Q8NER1 1/20 0.40
▸ MEN1 O00255 1/20 0.40

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
SCHEMBL13284207 0.98 MGLL (0.57) MGLLCA2CA1LPLLIPG
SCHEMBL13284206 0.98 MGLL (0.57) MGLLCA2CA1LPLLIPG
SCHEMBL17899782 0.86 MGLL (0.67) MGLLCA2LPLLIPGACHE
SCHEMBL6561397 0.82 ACHE (0.61) HSD17B1HSD17B2ENPP3ACHEPGR
SCHEMBL21340491 0.82 HSD17B2 (0.41) MGLLCA2CA1HSD17B1HSD17B2
SCHEMBL12419993 0.81 CA1 (0.82) MGLLCA2CA1HSD17B1HSD17B2
SCHEMBL2846622 0.81 MGLL (0.79) MGLLCA2CA1HSD17B1HSD17B2
SCHEMBL20955808 0.81 CA1 (0.82) MGLLCA2CA1HSD17B1HSD17B2
SCHEMBL30445177 0.81 CA1 (0.82) MGLLCA2CA1HSD17B1HSD17B2
SCHEMBL17003467 0.81 CA2 (0.58) MGLLCA2CA1LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3405192-B1 BRUTON'S TYROSINE KINASE INHIBITORS ZIBO BIOPOLAR CHANGSHENG PHARMACEUTICAL CO LTD (CN) 2024-12-11 — — EP disclosed
EP-3615027-B1 METHODS OF USE FOR TRISUBSTITUTED BENZOTRIAZOLE DERIVATIVES AS DIHYDROOROTATE OXYGENASE INHIBITORS AURIGENE DISCOVERY TECH LTD (IN) 2021-07-14 — — EP disclosed
US-10793566-B2 Bruton's tyrosine kinase inhibitors ZIBO BIOPOLAR CHANGSHENG PHARMACEUTICAL CO. LTD. (CN) 2020-10-06 — — US disclosed
EP-3419960-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-07-01 — — EP disclosed
US-10662187-B2 Bruton's tyrosine kinase inhibitors ZIBO BIOPOLAR CHANGSHENG PHARMACEUTICAL CO. LTD. (CN) 2020-05-26 — — US disclosed
US-20190276453-A1 BRUTON'S TYROSINE KINASE INHIBITORS SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2019-09-12 — — US disclosed
US-20180170904-A1 PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION VIIV Healthcare UK (No.5) Limited (GB) 2018-06-21 — — US disclosed
US-8569331-B2 Substituted benzo[f]lmidazo[1,2-d]pyrido[2,3-b][1,4]diazepine compounds ARQULE, INC. (US) 2013-10-29 — — US disclosed
US-20120267612-A1 CROSS-LINKABLE COPPER PHTHALOCYANINE COMPLEXES UNIVERSAL DISPLAY CORPORATION (US) 2012-10-25 — — US disclosed
WO-2012061342-A2 SUBSTITUTED BENZO-IMIDAZO-PYRIDO-DIAZEPINE COMPOUNDS ARQULE, INC. (US) 2012-05-10 — — WO disclosed
US-20120108574-A1 Substituted Benzo-Imidazo-Pyrido-Diazepine Compounds ARQULE, INC. (US) 2012-05-03 — — US disclosed
WO-2010082924-A1 CROSS-LINKABLE COPPER PHTHALOCYANINE COMPLEXES UNIVERSAL DISPLAY CORPORATION (US) 2010-07-22 — — WO disclosed
US-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-30 — — US disclosed
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 — — EP disclosed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 — — 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 (7 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-10662187-B2 Bruton's tyrosine kinase inhibitors BTK, ABL1, SYK MGLL 2799/4885CA2 3336/4885CA1 4768/4885
US-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors TNF, MMP9, MMP1 MGLL 2688/4885CA2 561/4885CA1 612/4885
US-20180170904-A1 PYRIDIN-3-YL ACETIC ACID DERIVATIVES AS INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION TYMP, TYMS, DUT MGLL 2956/4885CA2 3653/4885CA1 4474/4885
US-20120108574-A1 Substituted Benzo-Imidazo-Pyrido-Diazepine Compounds BRD4, BRPF3, BRD3 MGLL 4857/4885CA2 3143/4885CA1 3854/4885
US-10793566-B2 Bruton's tyrosine kinase inhibitors BTK, ABL1, SYK MGLL 2799/4885CA2 3336/4885CA1 4768/4885
US-20120267612-A1 CROSS-LINKABLE COPPER PHTHALOCYANINE COMPLEXES OCIAD1, OCIAD2, AOC2 MGLL 3454/4885CA2 2868/4885CA1 2120/4885
US-20190276453-A1 BRUTON'S TYROSINE KINASE INHIBITORS BTK, ABL1, SYK MGLL 2799/4885CA2 3336/4885CA1 4768/4885

“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.

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