SCHEMBL21364552

SCHEMBL21364552

Cc1nc(C)nc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc(C#N)cc3)cc2-c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2-n2c3ccccc3c3cc(-c4nc(C)nc(C)n4)ccc32)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 1/20 0.42
ABCG2 Q9UNQ0 10/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
CYP2D6 P10635 2/20 0.38
TSHR P16473 2/20 0.38
LMNA P02545 1/20 0.38
CYP2C9 P11712 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ABCB1 P08183 5/20 0.37
MAPK1 P28482 1/20 0.35
NPY5R Q15761 1/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CA P42336 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
SCHEMBL23965894 0.97 L3MBTL1 (0.40) PTGER4ABCG2L3MBTL1MEN1KMT2A
SCHEMBL21364374 0.96 PTGER4 (0.40) PTGER4ABCG2L3MBTL1MEN1KMT2A
SCHEMBL21364560 0.96 PTGER4 (0.40) PTGER4ABCG2L3MBTL1MEN1KMT2A
SCHEMBL21364968 0.95 PTGER4 (0.41) PTGER4ABCG2L3MBTL1MEN1KMT2A
SCHEMBL20794072 0.95 PTGER4 (0.42) PTGER4ABCG2L3MBTL1MEN1KMT2A
SCHEMBL20655561 0.94 PTGER4 (0.43) PTGER4ABCG2MEN1KMT2AALDH1A1
SCHEMBL21364541 0.94 ABCG2 (0.41) PTGER4ABCG2MEN1KMT2ACYP1A2
SCHEMBL21364333 0.94 ABCG2 (0.41) PTGER4ABCG2MEN1KMT2ACYP1A2
SCHEMBL21364582 0.94 PTGER4 (0.38) PTGER4ABCG2L3MBTL1MEN1KMT2A
SCHEMBL21364667 0.93 CYP1A2 (0.46) PTGER4ABCG2L3MBTL1MEN1KMT2A

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 PTGER4 1462/4885ABCG2 3275/4885L3MBTL1 4251/4885
US-11161836-B2 Organic molecules for optoelectronic devices OR10J3, OR51E2, OCIAD2 PTGER4 1462/4885ABCG2 3275/4885L3MBTL1 4251/4885

“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.