SCHEMBL25850758

SCHEMBL25850758

c1ccc(-c2cccc(-c3ccc4ccc5ccc(-c6cccc(-c7cccc(-c8ccc9ccc%10ccc(-c%11cccc(-c%12ccccc%12)c%11)nc%10c9n8)c7)c6)nc5c4n3)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.49
MEN1 O00255 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 1/20 0.48
KMO O15229 2/20 0.44
CYP11B1 P15538 1/20 0.41
CYP11B2 P19099 1/20 0.41
ASIC3 Q9UHC3 1/20 0.41
MAOA P21397 1/20 0.40
CYP19A1 P11511 1/20 0.40
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39

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
SCHEMBL21103888 0.98 MEN1 (0.52) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL10032413 0.96 MEN1 (0.50) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL21103662 0.96 MEN1 (0.50) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL21103770 0.96 MEN1 (0.50) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL31326563 0.96 MEN1 (0.54) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL10032415 0.96 MEN1 (0.54) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL10032340 0.96 MEN1 (0.54) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL21103672 0.94 PARP1 (0.49) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL21103768 0.94 PARP1 (0.49) PARP1MEN1RAB9AKMT2AKMO
SCHEMBL21103679 0.94 PARP1 (0.49) PARP1MEN1RAB9AKMT2AKMO

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-11711972-B1 Organic electronic element comprising compound for organic electronic element and an electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-07-25 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-11711972-B1 Organic electronic element comprising compound for organic electronic element and an electronic device thereof PPOX, ESR1, CCNE2 PARP1 1212/4885MEN1 703/4885RAB9A 3491/4885

“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.