SCHEMBL21364501

SCHEMBL21364501

Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(-c2cc(-c3ccccc3C#N)ccc2-n2c3ccccc3c3cc(C)ccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.37
GABRA1 P14867 5/20 0.35
GABRG2 P18507 5/20 0.35
GABRB3 P28472 5/20 0.35
GABRA2 P47869 4/20 0.35
GABRA5 P31644 3/20 0.35
GABRA3 P34903 3/20 0.35
TRPA1 O75762 1/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
LMNA P02545 2/20 0.33
MAPK1 P28482 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PPARG P37231 1/20 0.32
CYP1A2 P05177 5/20 0.32
CYP3A4 P08684 4/20 0.32
HSD17B10 Q99714 3/20 0.32
CYP2C9 P11712 3/20 0.32
KDM4E B2RXH2 2/20 0.32
TP53 P04637 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
SCHEMBL21364499 0.97 NR3C1 (0.39) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364332 0.95 NR3C1 (0.37) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364329 0.95 NR3C1 (0.36) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364507 0.94 NR3C1 (0.35) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364819 0.94 NR3C1 (0.40) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364518 0.93 NR3C1 (0.39) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364328 0.93 NR3C1 (0.35) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL23965885 0.92 NR3C1 (0.36) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364322 0.92 NR3C1 (0.38) NR3C1GABRA1GABRG2GABRB3GABRA2
SCHEMBL21364821 0.92 NR3C1 (0.39) NR3C1GABRA1GABRG2GABRB3GABRA5

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-11161836-B2 Organic molecules for optoelectronic devices CYNORA GMBH (DE) 2021-11-02 US disclosed
US-20190284174-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-19 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 (2 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-20190284174-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 NR3C1 4626/4885GABRA1 3131/4885GABRG2 2129/4885
US-11161836-B2 Organic molecules for optoelectronic devices OR10J3, OR51E2, OCIAD2 NR3C1 4626/4885GABRA1 3131/4885GABRG2 2129/4885

“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.