SCHEMBL19913175

SCHEMBL19913175

N#Cc1cc(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c(-c2ccncc2)c(-n2c3ccccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.41
ABCG2 Q9UNQ0 6/20 0.41
CYP3A4 P08684 5/20 0.41
CYP2C9 P11712 2/20 0.41
USP2 O75604 1/20 0.41
HPGD P15428 1/20 0.41
CASP1 P29466 1/20 0.41
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
ALDH1A1 P00352 3/20 0.37
LMNA P02545 3/20 0.37
TSHR P16473 3/20 0.37
CYP2D6 P10635 3/20 0.37
CYP2C19 P33261 2/20 0.37
CLK4 Q9HAZ1 2/20 0.37
HSD17B10 Q99714 2/20 0.37
MAPK14 Q16539 3/20 0.35
MAPK13 O15264 1/20 0.35
RAF1 P04049 1/20 0.35
MAPK12 P53778 1/20 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
SCHEMBL19913174 0.97 ABCG2 (0.40) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL19913173 0.94 ABCG2 (0.41) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL19913150 0.91 MAPK14 (0.39) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL19919779 0.90 ABCG2 (0.40) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL19908995 0.90 MAPK14 (0.36) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL19909117 0.89 MAPK14 (0.39) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL22760937 0.88 CYP1A2 (0.47) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL19913335 0.88 SQOR (0.37) CYP1A2ABCG2CYP3A4CYP2C9USP2
SCHEMBL19913152 0.88 IMPDH2 (0.39) CLK4MAPK14MAPK13RAF1MAPK12
SCHEMBL19909164 0.87 USP2 (0.40) CYP1A2ABCG2CYP3A4CYP2C9USP2

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 5 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
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 CYP1A2 344/4885ABCG2 624/4885CYP3A4 339/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 CYP1A2 2290/4885ABCG2 3492/4885CYP3A4 1955/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 CYP1A2 344/4885ABCG2 624/4885CYP3A4 339/4885

“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.