SCHEMBL17482874

SCHEMBL17482874

c1ccc(-c2ccc3c(c2)Oc2ccccc2C32c3ccccc3Oc3cc(-c4cccc5oc6ccccc6c45)ccc32)nc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.38
BACE1 P56817 4/20 0.35
CTSD P07339 2/20 0.35
PRKDC P78527 1/20 0.35
KCNH2 Q12809 2/20 0.33
AHR P35869 1/20 0.33
ALOX5 P09917 1/20 0.33
NPY5R Q15761 1/20 0.33
MAPT P10636 3/20 0.32
NPC1 O15118 2/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
HSD17B10 Q99714 2/20 0.31
GAA P10253 1/20 0.31
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ATM Q13315 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
SCHEMBL17483018 0.92 PDK2 (0.36) PDK2BACE1CTSDPRKDCKCNH2
SCHEMBL17482883 0.91 PDK2 (0.36) PDK2BACE1CTSDPRKDCKCNH2
SCHEMBL17482899 0.89 ALOX5 (0.37) BACE1AHRALOX5MAPTNPC1
SCHEMBL17482903 0.88 KDM4E (0.39) BACE1CTSDALOX5MAPTNPC1
SCHEMBL17482901 0.86 ALOX5 (0.32) ALOX5
SCHEMBL17482873 0.85 PLA2G2A (0.37) PDK2BACE1PRKDCAHRALOX5
SCHEMBL17482894 0.84 ALOX5 (0.32) ALOX5
SCHEMBL17483019 0.84 IDO1 (0.31)
SCHEMBL17483020 0.84 KDM4E (0.39) BACE1CTSDALOX5MAPTKDM4E
SCHEMBL17482878 0.84 PDK2 (0.37) PDK2BACE1CTSDPRKDCKCNH2

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-20160035986-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-02-04 US disclosed
US-20160035986-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-02-04 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-20160035986-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, CCNA1 PDK2 2404/4885BACE1 533/4885CTSD 2705/4885

“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.