SCHEMBL27019083

SCHEMBL27019083

N#Cc1ccc(-n2c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccccc4C#N)cc3-n3c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4c4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc43)n2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 7/20 0.37
CYP3A4 P08684 7/20 0.37
HSD17B10 Q99714 5/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
HPGD P15428 3/20 0.37
KDM4E B2RXH2 2/20 0.37
LMNA P02545 2/20 0.37
MAPT P10636 1/20 0.37
NR3C1 P04150 1/20 0.36
ALDH1A1 P00352 6/20 0.35
TRPA1 O75762 1/20 0.34
CLK4 Q9HAZ1 4/20 0.34
CYP2C19 P33261 3/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
TSHR P16473 2/20 0.34
GABRG2 P18507 4/20 0.34
GABRB3 P28472 4/20 0.34
GABRA1 P14867 3/20 0.34

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
SCHEMBL27015838 0.97 CYP1A2 (0.35) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL24924888 0.97 CYP1A2 (0.36) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL27019438 0.96 CYP1A2 (0.37) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL22242951 0.96 NR3C1 (0.37) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL27019916 0.95 CYP1A2 (0.38) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL21090296 0.95 NR3C1 (0.39) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL20156171 0.95 NR3C1 (0.39) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL27019047 0.94 CYP1A2 (0.35) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL27019436 0.94 CYP1A2 (0.35) CYP1A2CYP3A4HSD17B10MEN1KMT2A
SCHEMBL22242950 0.93 TRPA1 (0.36) CYP1A2CYP3A4HSD17B10MEN1KMT2A

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-20240018127-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2024-01-18 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-20240018127-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OR10J3, ORC3, ORAI3 CYP1A2 1598/4885CYP3A4 1217/4885HSD17B10 4402/4885

“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.