SCHEMBL23487339

SCHEMBL23487339

N#Cc1cc(-n2c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)c(-n2c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc32)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 9/20 0.44
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 4/20 0.43
MAPT P10636 3/20 0.43
HPGD P15428 3/20 0.43
NTSR1 P30989 1/20 0.40
ABCB1 P08183 5/20 0.39
LMNA P02545 4/20 0.39
KDM4E B2RXH2 3/20 0.39
GLA P06280 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MYC P01106 1/20 0.38
ALDH1A3 P47895 2/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL23487262 0.97 ABCG2 (0.42) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL21108318 0.95 ABCG2 (0.42) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL22563518 0.93 ALDH1A3 (0.40) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL22563571 0.93 MYC (0.42) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL19919655 0.92 ABCG2 (0.41) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL22563562 0.92 MYC (0.44) ABCG2ABCB1LMNAKDM4EMYC
SCHEMBL21108321 0.92 CYP1A2 (0.40) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL21108012 0.92 ABCG2 (0.41) ABCG2MEN1KMT2AALDH1A1ABCB1
SCHEMBL22563593 0.91 ABCG2 (0.39) ABCG2MEN1KMT2AALDH1A1MAPT
SCHEMBL21278796 0.91 ABCG2 (0.46) ABCG2MEN1KMT2AALDH1A1MAPT

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.