SCHEMBL21099271

SCHEMBL21099271

O=S(=O)(c1ccc2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc3)cc2c1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA9 Q16790 2/20 0.40
MEN1 O00255 2/20 0.37
HPGD P15428 2/20 0.37
KMT2A Q03164 2/20 0.37
S1PR4 O95977 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
S1PR1 P21453 1/20 0.37
SDHB P21912 1/20 0.37
MAPK1 P28482 1/20 0.37
STAT3 P40763 1/20 0.37
STAT1 P42224 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TLR9 Q9NR96 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
SCHEMBL17829433 0.81 CA2 (0.44) CA1CA2CA9MEN1HPGD
SCHEMBL17829449 0.78 CA2 (0.46) CA1CA2CA9MEN1HPGD
SCHEMBL17829440 0.77 CA1 (0.43) CA1CA2CA9MEN1HPGD
SCHEMBL17829442 0.77 CA1 (0.43) CA1CA2CA9MEN1HPGD
SCHEMBL15850715 0.73 ESR1 (0.61) MEN1HPGDKMT2ALMNATP53
SCHEMBL17655916 0.73 ESR1 (0.61) MEN1HPGDKMT2ALMNATP53
SCHEMBL25453605 0.73 CA2 (0.44) CA1CA2CA9MEN1HPGD
SCHEMBL17655915 0.72 CA2 (0.42) CA1CA2CA9MEN1KMT2A
SCHEMBL21188129 0.72 ESR1 (0.59) MEN1HPGDKMT2ALMNATP53
SCHEMBL21188130 0.72 ESR1 (0.59) MEN1HPGDKMT2ALMNATP53

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-10323006-B2 Heterocyclic compound and organic light emitting element using same LG CHEM, LTD. (KR) 2019-06-18 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-10323006-B2 Heterocyclic compound and organic light emitting element using same CRY1, CRY2, NR2E3 CA1 2920/4885CA2 3796/4885CA9 1855/4885

“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.