SCHEMBL23487294

SCHEMBL23487294

Cc1cc(C)c(-c2ccc3c4ccccc4n(-c4cc(C#N)c(-c5nc(C)cc(C)n5)cc4-n4c5ccccc5c5ccc(-c6c(C)cc(C)cc6C)cc54)c3c2)c(C)c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.32
FFAR1 O14842 1/20 0.31
ALDH1A1 P00352 4/20 0.31
KDM4E B2RXH2 3/20 0.31
GLA P06280 3/20 0.31
GAA P10253 2/20 0.31
HTT P42858 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
NSD2 O96028 1/20 0.31
HPGD P15428 2/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30
S1PR2 O95136 1/20 0.30
S1PR4 O95977 1/20 0.30
S1PR1 P21453 1/20 0.30
MAT2A P31153 1/20 0.30
SLC22A12 Q96S37 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
SCHEMBL23487343 0.94 CYP1A2 (0.33) ABCG2FFAR1ALDH1A1KDM4EGLA
SCHEMBL21108346 0.92 PTGER4 (0.31) ALDH1A1KDM4EGLAGAAHTT
SCHEMBL19919635 0.91 ALDH1A1 (0.32) ALDH1A1KDM4EGLAGAAHTT
SCHEMBL23487749 0.90 GRIN1 (0.33) ABCG2FFAR1ALDH1A1KDM4EGLA
SCHEMBL23487353 0.89 GRM2 (0.35) ABCG2ALDH1A1KDM4EGLAGAA
SCHEMBL23487650 0.89 MAOA (0.33) ABCG2ALDH1A1KDM4EGLAGAA
SCHEMBL22563525 0.88 AR (0.40) ABCG2ALDH1A1KDM4EGLAGAA
SCHEMBL23487292 0.88 CYP1A2 (0.38) ABCG2ALDH1A1KDM4EGLANPSR1
SCHEMBL23487356 0.87 AR (0.37) ABCG2ALDH1A1KDM4EGLAGAA
SCHEMBL19913245 0.87 ALDH1A1 (0.31) ALDH1A1KDM4EGLAGAAHTT

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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 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 (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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 ABCG2 2612/4885FFAR1 4215/4885ALDH1A1 80/4885

“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.