SCHEMBL22908016

SCHEMBL22908016

N#Cc1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3-c3ccccc3C43c4ccccc4Sc4ccccc43)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 15/20 0.38
ABCB1 P08183 9/20 0.38
ABCC1 P33527 4/20 0.34
PDK2 Q15119 1/20 0.33
IDO1 P14902 1/20 0.33
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CLK4 Q9HAZ1 1/20 0.32
HRH4 Q9H3N8 1/20 0.32
AR P10275 1/20 0.32

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
SCHEMBL21343105 0.93 ABCG2 (0.37) ABCG2ABCB1ABCC1PDK2MEN1
SCHEMBL23257040 0.93 ABCG2 (0.35) ABCG2ABCB1ABCC1PDK2IDO1
SCHEMBL21701888 0.92 ABCG2 (0.37) ABCG2ABCB1ABCC1PDK2TSHR
SCHEMBL21343160 0.92 ABCG2 (0.34) ABCG2ABCB1ABCC1PDK2
SCHEMBL23257141 0.92 ABCG2 (0.34) ABCG2ABCB1ABCC1PDK2
SCHEMBL22908083 0.91 ABCG2 (0.39) ABCG2ABCB1PDK2MEN1LMNA
SCHEMBL21702199 0.91 ABCG2 (0.39) ABCG2ABCB1ABCC1PDK2MEN1
SCHEMBL22908022 0.91 CYP1A2 (0.34) ABCG2ABCB1PDK2IDO1CYP1A2
SCHEMBL22908055 0.91 ABCG2 (0.35) ABCG2ABCB1ABCC1PDK2IDO1
SCHEMBL23257649 0.90 ABCG2 (0.34) ABCG2ABCB1ABCC1PDK2

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-20210143344-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2021-05-13 US disclosed
US-20210020842-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2021-01-21 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 (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-20210020842-A1 ORGANIC LIGHT-EMITTING DEVICE OR10J3, OR51E2, LOXL1 ABCG2 4711/4885ABCB1 3834/4885ABCC1 3846/4885

“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.