SCHEMBL11200729

SCHEMBL11200729

NCc1ncc2nc[nH]c2n1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.31
APEX1 P27695 1/20 0.31
RECQL P46063 1/20 0.31
BLM P54132 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL5062914 0.81 KDM4E (0.32) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL9936008 0.81 KDM4E (0.32) KDM4EALDH1A1GLAGAAHPGD
Hydrochloric Acid SCHEMBL21174542 0.79 KDM4E (0.32) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL6948806 0.78 JAK2 (0.32) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL11066168 0.78 PDK2 (0.35) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL23409493 0.78 HTT (0.39) HSD17B10
SCHEMBL30842861 0.78 HTT (0.39) HSD17B10
SCHEMBL1797752 0.78
SCHEMBL7420623 0.77 PARP1 (0.30) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL6006918 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3510404-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF Pharmakea, Inc. (US) 2019-07-17 EP claimed
US-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF PHARMAKEA, INC. 2019-06-27 US claimed
WO-2018048928-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 WO claimed
CN-111132721-B Multiple-inflation type intravascular medical device W.L.戈尔及同仁股份有限公司 2022-07-19 CN disclosed
CN-109689692-B Bispecific antibodies and antibody conjugates for tumor therapy and uses thereof 本康生物制药(深圳)有限公司 2021-11-12 CN disclosed
CN-110651996-A Food for nourishing and improving kidney function and preparation method thereof 马晨光 2020-01-07 CN disclosed
EP-3510404-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF Pharmakea, Inc. (US) 2019-07-17 EP disclosed
US-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF PHARMAKEA, INC. 2019-06-27 US disclosed
WO-2018048928-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 WO disclosed
EP-0069507-A2 Hydrocarbon compositions containing heteroaromatic nitrogen compounds EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-01-12 EP 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 (1 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-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF LOXL2, LOXL1, LOXL3 KDM4E 3469/4885ALDH1A1 1508/4885GLA 482/4885

“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.