SCHEMBL24903010

SCHEMBL24903010

c1ccc(-c2ccccc2N(c2ccc(-c3cccc(-c4ccccc4-n4c5ccccc5c5ccccc54)c3)cc2)c2ccc(-c3cccc4ccccc34)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
MCL1 Q07820 1/20 0.34
ACMSD Q8TDX5 1/20 0.34
SLC6A9 P48067 1/20 0.31
PPARG P37231 4/20 0.31
PPARA Q07869 4/20 0.31
NTSR1 P30989 2/20 0.31
MAPK14 Q16539 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TNF P01375 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31

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
SCHEMBL24902995 1.00 CA12 (0.39) CA12CA1CA2CA9MCL1
SCHEMBL24902269 1.00 CA12 (0.39) CA12CA1CA2CA9MCL1
SCHEMBL24903009 0.97 CA12 (0.37) CA12CA1CA2CA9MCL1
SCHEMBL24902343 0.96 CA12 (0.39) CA12CA1CA2CA9MCL1
SCHEMBL24902582 0.96 CA12 (0.36) CA12CA1CA2CA9MCL1
SCHEMBL24903107 0.96 CA12 (0.36) CA12CA1CA2CA9MCL1
SCHEMBL24946634 0.96 CA12 (0.36) CA12CA1CA2CA9MCL1
SCHEMBL23154753 0.96 CA12 (0.36) CA12CA1CA2CA9MCL1
SCHEMBL27361089 0.95 CA12 (0.37) CA12CA1CA2CA9MCL1
SCHEMBL24903174 0.94 KDM4E (0.34) MAPK14ALDH1A1TSPO

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-20230023811-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-01-26 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-20230023811-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE PIEZO1, LEF1, TMEM109 CA12 1295/4885CA1 1299/4885CA2 2404/4885

“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.