SCHEMBL19919474

SCHEMBL19919474

N#Cc1cc(-n2c3ccccc3c3cc(-c4ccccc4C#N)ccc32)c(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)c(-n2c3ccccc3c3cc(-c4ccccc4C#N)ccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 7/20 0.41
GABRB3 P28472 7/20 0.41
GABRA5 P31644 5/20 0.41
GABRA3 P34903 5/20 0.41
TRPA1 O75762 1/20 0.38
NR3C1 P04150 1/20 0.37
MYC P01106 1/20 0.36
CYP1A2 P05177 6/20 0.36
CYP3A4 P08684 6/20 0.36
HSD17B10 Q99714 4/20 0.36
HPGD P15428 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 1/20 0.36
GABRA1 P14867 6/20 0.35
ALDH1A1 P00352 4/20 0.35
GABRA2 P47869 4/20 0.35
CLK4 Q9HAZ1 3/20 0.35

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
SCHEMBL19919730 0.97 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA3TRPA1
SCHEMBL19913333 0.93 MYC (0.38) GABRG2GABRB3GABRA5GABRA3MYC
SCHEMBL19909131 0.92 MYC (0.37) GABRG2GABRB3GABRA5GABRA3MYC
SCHEMBL23487694 0.92 GABRG2 (0.39) GABRG2GABRB3GABRA5GABRA3TRPA1
SCHEMBL19909175 0.90 MYC (0.42) GABRG2GABRB3GABRA5GABRA3MYC
SCHEMBL19909118 0.89 ADORA2A (0.36) GABRG2GABRB3GABRA5GABRA3TRPA1
SCHEMBL19908996 0.89 GABRG2 (0.36) GABRG2GABRB3GABRA5GABRA3TRPA1
SCHEMBL19909392 0.89 MYC (0.39) GABRG2GABRB3GABRA5GABRA3MYC
SCHEMBL22563369 0.89 GABRG2 (0.41) GABRG2GABRB3GABRA5GABRA3TRPA1
SCHEMBL21414196 0.88 CYP1A2 (0.38) GABRG2GABRB3GABRA5GABRA3TRPA1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 GABRG2 1265/4885GABRB3 497/4885GABRA5 2373/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 GABRG2 3357/4885GABRB3 2623/4885GABRA5 4415/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 GABRG2 1265/4885GABRB3 497/4885GABRA5 2373/4885

“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.