SCHEMBL23487263

SCHEMBL23487263

Cc1cc(C)nc(-c2c(-n3c4cc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)ccc4c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc43)cc(C#N)cc2-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)n1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 15/20 0.46
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
TSHR P16473 1/20 0.38
HSD17B10 Q99714 1/20 0.38
ABCB1 P08183 4/20 0.38
MAPK1 P28482 1/20 0.36
ATM Q13315 1/20 0.35
ABCC1 P33527 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
SCHEMBL23487261 0.97 ABCG2 (0.44) ABCG2MEN1KMT2ALMNAALDH1A1
SCHEMBL22563570 0.93 ABCG2 (0.43) ABCG2MEN1KMT2AALDH1A1HSD17B10
SCHEMBL19913299 0.91 ABCG2 (0.41) ABCG2MEN1KMT2ALMNAALDH1A1
SCHEMBL21108317 0.91 L3MBTL1 (0.42) ABCG2MEN1KMT2ALMNAALDH1A1
SCHEMBL22563500 0.90 ABCG2 (0.41) ABCG2MEN1KMT2ALMNAALDH1A1
SCHEMBL22563567 0.89 ABCG2 (0.36) ABCG2KMT2A
SCHEMBL22563588 0.89 CHEK1 (0.36) ABCG2
SCHEMBL21108320 0.88 L3MBTL1 (0.40) ABCG2MEN1KMT2ALMNAALDH1A1
SCHEMBL19913297 0.88 ABCG2 (0.39) ABCG2MEN1KMT2ALMNAALDH1A1
SCHEMBL22563516 0.88 ABCG2 (0.37) ABCG2MEN1KMT2ALMNAALDH1A1

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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2021-06-10 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-20210175434-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, OR51E2, OCIAD2 ABCG2 2612/4885MEN1 2472/4885KMT2A 3474/4885

“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.