SCHEMBL2605174

SCHEMBL2605174

C=CCOc1nc(C=C)nc(OCC=C)n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ CDK1 P06493 1/20 0.31
▸ CCNB1 P14635 1/20 0.31
▸ MGMT P16455 1/20 0.31
▸ CCNA2 P20248 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ CCNA1 P78396 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL18194708 0.95 MAPT (0.47) MAPK1MAPTCDK1CCNB1MGMT
SCHEMBL23181 0.88 MAPK1 (0.55) MAPK1MAPTCDK1CCNB1MGMT
Hydrogen Sulfide SCHEMBL20395887 0.85 MAPK1 (0.53) MAPK1MAPTCDK1CCNB1MGMT
SCHEMBL16222144 0.83 MAPT (0.44) MAPK1MAPT
SCHEMBL10798317 0.81 MAPK1 (0.50) MAPK1MAPTCDK1CCNB1MGMT
SCHEMBL4115128 0.77 MAPT (0.47) MAPK1MAPTHSD17B10
SCHEMBL21875991 0.77 MAPK1 (0.47) MAPK1MAPTCDK1CCNB1MGMT
SCHEMBL11803039 0.77 MAPK1 (0.47) MAPK1MAPTPOLB
SCHEMBL4111687 0.77 MAPK1 (0.47) MAPK1MAPTPOLB
SCHEMBL154305 0.77 MAPT (0.47) MAPK1MAPTCDK1CCNB1MGMT

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
US-11713377-B2 Polyolefin pipe UPONOR INNOVATION AB (SE) 2023-08-01 — — US disclosed
US-9963573-B2 Polyolefin pipe UPONOR INNOVATION AB (SE) 2018-05-08 — — US disclosed
US-20180057644-A1 Polyolefin Pipe UPONOR INNOVATION AB (SE) 2018-03-01 — — US disclosed
US-20170114193-A1 Polyolefin Pipe UPONOR INNOVATION AB (SE) 2017-04-27 — — US disclosed
US-20160319162-A1 THERMALLY RESISTANT ANAEROBICALLY CURABLE COMPOSITIONS HENKEL AG & CO. KGAA (DE) 2016-11-03 — — US disclosed
US-20160160085-A1 BONDING COMPOSITION AND COMPONENT THEREOF, AND METHOD OF USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY 2016-06-09 — — US disclosed
US-20160130420-A1 Polyolefin Pipe UPONOR INNOVATION AB (SE) 2016-05-12 — — US disclosed
US-8815988-B2 Resin compound, resin composition, and resin-molded product FUJI XEROX CO., LTD. (JP) 2014-08-26 — — US disclosed
US-8691984-B2 Method of storing triallyl isocyanurate NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2014-04-08 — — US disclosed
US-20130158173-A1 RESIN COMPOUND, RESIN COMPOSITION, AND RESIN-MOLDED PRODUCT FUJI XEROX CO., LTD. (JP) 2013-06-20 — — US disclosed
US-8431697-B2 Triallyl isocyanurate, triallyl cyanurate and process for producing triallyl isocyanurate NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2013-04-30 — — US disclosed
US-20130029070-A1 CROSSLINKABLE COMPOSITION, CROSSLINKED PRODUCT AND METHOD FOR PRODUCTION THEREOF, MULTILAYERED STRUCTURE, CROSSLINKING AGENT, AND COMPOUND AND METHOD FOR PRODUCTION THEREOF KURARAY CO., LTD. (JP) 2013-01-31 — — US disclosed
US-20120095225-A1 METHOD OF STORING TRIALLYL ISOCYANURATE NIPPON KASEI CHEMICAL COMPANY LIMITED (JP) 2012-04-19 — — US disclosed
US-20120095223-A1 TRIALLYL ISOCYANURATE, TRIALLYL CYANURATE AND PROCESS FOR PRODUCING TRIALLYL ISOCYANURATE NIPPON CHEMICAL COMPANY LIMITED (JP) 2012-04-19 — — US disclosed
US-20110255156-A1 MONOMERS AND POLYMERS FOR OPTICAL ELEMENTS OPHTHONIX, INC. (US) 2011-10-20 — — 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-20130029070-A1 CROSSLINKABLE COMPOSITION, CROSSLINKED PRODUCT AND METHOD FOR PRODUCTION THEREOF, MULTILAYERED STRUCTURE, CROSSLINKING AGENT, AND COMPOUND AND METHOD FOR PRODUCTION THEREOF F2, C9, FGB MAPK1 4165/4885MAPT 1510/4885CDK1 392/4885
US-20120095225-A1 METHOD OF STORING TRIALLYL ISOCYANURATE TIMCC, TST, TMT1A MAPK1 2473/4885MAPT 1336/4885CDK1 484/4885
US-20120095223-A1 TRIALLYL ISOCYANURATE, TRIALLYL CYANURATE AND PROCESS FOR PRODUCING TRIALLYL ISOCYANURATE CA9, CROCC, CA2 MAPK1 2768/4885MAPT 3564/4885CDK1 1156/4885

“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.

Send feedback