SCHEMBL19213258

SCHEMBL19213258

c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)oc3c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5oc43)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
TDP1 Q9NUW8 5/20 0.38
L3MBTL1 Q9Y468 5/20 0.38
KDM4E B2RXH2 5/20 0.38
MAPT P10636 5/20 0.38
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PRKDC P78527 1/20 0.37
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35
MMP12 P39900 1/20 0.34
MMP13 P45452 1/20 0.34
MEN1 O00255 6/20 0.33
KMT2A Q03164 6/20 0.33
ATM Q13315 2/20 0.33
PGR P06401 1/20 0.33
CRHBP P24387 1/20 0.33

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
SCHEMBL19887117 0.94 PLA2G2A (0.39) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL10110694 0.89 MMP12 (0.41) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL16850528 0.88 PRKDC (0.40) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL19445011 0.88 PRKDC (0.40) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL17875602 0.87 ALDH1A1 (0.42) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL13508218 0.87 KDM4E (0.34) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL19887132 0.86 PLA2G2A (0.42) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL16850523 0.86 PRKDC (0.41) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL16850530 0.86 PRKDC (0.41) ALDH1A1TDP1L3MBTL1KDM4EMAPT
SCHEMBL14295657 0.85 PRKDC (0.39) ALDH1A1TDP1L3MBTL1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10193070-B2 Electroactive materials E I DU PONT DE NEMOURS AND COMPANY (US) 2019-01-29 US disclosed
US-20170229654-A1 ELECTROACTIVE MATERIALS LG CHEM, LTD. (KR) 2017-08-10 US disclosed
US-20170229654-A1 ELECTROACTIVE MATERIALS LG CHEM, LTD. (KR) 2017-08-10 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 (2 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-10193070-B2 Electroactive materials EPX, INA, KCNN2 ALDH1A1 476/4885TDP1 2384/4885L3MBTL1 4688/4885
US-20170229654-A1 ELECTROACTIVE MATERIALS EPX, INA, KCNN2 ALDH1A1 476/4885TDP1 2384/4885L3MBTL1 4688/4885

“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.