SCHEMBL17485149

SCHEMBL17485149

CC1(C)OB(c2cccc3c2-c2c(cccc2B2OC(C)(C)C(C)(C)O2)Oc2ccccc2-c2ccccc2O3)OC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
LPL P06858 8/20 0.38
LIPG Q9Y5X9 8/20 0.38
SETD7 Q8WTS6 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
JAK2 O60674 1/20 0.30
BTK Q06187 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
SCHEMBL21764400 0.83 LPL (0.37) KDM4EMAPK1ATMLPLLIPG
SCHEMBL15713669 0.80 LPL (0.33) KDM4EMAPK1ATMLPLLIPG
SCHEMBL30800709 0.80 LPL (0.33) KDM4EMAPK1ATMLPLLIPG
SCHEMBL15282016 0.78 KDM4E (0.45) KDM4EMAPK1ATMLPLLIPG
SCHEMBL15396621 0.78 KDM4E (0.45) KDM4EMAPK1ATMLPLLIPG
SCHEMBL34467624 0.78 KDM4E (0.31) KDM4EMAPK1ATM
SCHEMBL18563346 0.77 AHR (0.43) LPLLIPGJAK2BTK
SCHEMBL29507270 0.77 LPL (0.48) MAPK1LPLLIPG
SCHEMBL20232183 0.77 LPL (0.48) MAPK1LPLLIPG
SCHEMBL26179575 0.76 LPL (0.37) LPLLIPG

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 1 patent. 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

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 KDM4E 2785/4885MAPK1 2126/4885ATM 1515/4885

“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.