SCHEMBL14788293

SCHEMBL14788293

CC(C)(C)c1nc2nc(C(C)(C)C)oc2o1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.35
KDM4E B2RXH2 2/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
HPGD P15428 2/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 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
SCHEMBL16329823 0.89 ELANE (0.32) ELANE
SCHEMBL12309181 0.67 ELANE (0.33) ELANEKDM4EPOLBRAB9A
SCHEMBL10212104 0.65 ELANE (0.35) ELANEKDM4EPOLBRAB9A
SCHEMBL2705397 0.65 LMNA (0.36) ELANEKDM4EATML3MBTL1ALDH1A1
SCHEMBL13587131 0.64 ELANE (0.31) ELANE
SCHEMBL14866999 0.64 LMNA (0.32) ELANE
SCHEMBL10227005 0.63 ELANE (0.34) ELANEKDM4EPOLBRAB9A
SCHEMBL21721367 0.63 ELANE (0.37) ELANEKDM4EPOLBRAB9AALDH1A1
SCHEMBL21791911 0.63 ELANE (0.33) ELANEKDM4EPOLBRAB9A
SCHEMBL12920796 0.63 ELANE (0.33) ELANEKDM4EPOLBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10770665-B2 Fluorinated dye compounds for organic solar cells NEXT ENERGY TECHNOLOGY, INC. (US) 2020-09-08 US disclosed
US-20180114930-A1 FLUORINATED DYE COMPOUNDS FOR ORGANIC SOLAR CELLS NEXT ENERGY TECHNOLOGIES, INC. (US) 2018-04-26 US disclosed
US-8975235-B2 Lysophosphatidic acid receptor antagonists INTERMUNE, INC. (US) 2015-03-10 US disclosed
US-20140213538-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. 2014-07-31 US disclosed
US-20140200215-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. 2014-07-17 US disclosed
US-20130072449-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS INTERMUNE, INC. (US) 2013-03-21 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 (4 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-20140213538-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 ELANE 440/4885KDM4E 4418/4885POLB 4247/4885
US-10770665-B2 Fluorinated dye compounds for organic solar cells OR10J3, EPCAM, KCNN2 ELANE 2213/4885KDM4E 2632/4885POLB 3468/4885
US-20130072449-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 ELANE 440/4885KDM4E 4418/4885POLB 4247/4885
US-20140200215-A1 LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS LPAR1, LPAR2, LPAR5 ELANE 440/4885KDM4E 4418/4885POLB 4247/4885

“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.