SCHEMBL14298980

SCHEMBL14298980

COc1cc(OC)nc(O[C@H](C)C(C)C)n1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
EDNRB P24530 14/20 0.42
EDNRA P25101 14/20 0.42
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 1/20 0.36

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
SCHEMBL6335452 0.83 L3MBTL1 (0.48) L3MBTL1EDNRBEDNRALMNASMN1; SMN2
SCHEMBL9407404 0.76 EDNRB (0.40) L3MBTL1EDNRBEDNRALMNATDP1
SCHEMBL9412038 0.76 EDNRB (0.43) L3MBTL1EDNRBEDNRALMNASMN1; SMN2
SCHEMBL12757466 0.75 LMNA (0.47) L3MBTL1EDNRBEDNRALMNASMN1; SMN2
SCHEMBL14325441 0.74 EDNRB (0.52) EDNRBEDNRALMNATDP1
SCHEMBL7825117 0.74 EDNRB (0.52) EDNRBEDNRALMNATDP1
SCHEMBL14298965 0.74 EDNRB (0.46) EDNRBEDNRALMNASMN1; SMN2TDP1
SCHEMBL14298973 0.74 EDNRB (0.46) EDNRBEDNRALMNASMN1; SMN2TDP1
SCHEMBL439716 0.74 LMNA (0.59) L3MBTL1LMNASMN1; SMN2TDP1CYP1A2
SCHEMBL7808396 0.73 EDNRB (0.45) EDNRBEDNRALMNASMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9573907-B2 2, 4-pyrimidine derivatives and use thereof SNU R&DB FOUNDATION (KR) 2017-02-21 US disclosed
US-20120322802-A1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-12-20 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 (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-20120322802-A1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF LY96, AIMP1, NLRP1 L3MBTL1 3319/4885EDNRB 4586/4885EDNRA 4633/4885

“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.