SCHEMBL22044443

SCHEMBL22044443

Fc1cc(-c2nncnn2)ccc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 11/20 0.51
▸ CYP11B2 P19099 9/20 0.47
▸ CYP11B1 P15538 6/20 0.47

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
SCHEMBL35210214 1.00 KIF11 (0.51) KIF11CYP11B2CYP11B1
SCHEMBL21116892 0.78 KIF11 (0.76) KIF11CYP11B2CYP11B1
SCHEMBL22043741 0.74 KDM4E (0.44) —
SCHEMBL22043740 0.74 MAPT (0.40) —
SCHEMBL22043754 0.74 ALDH1A1 (0.43) KIF11
SCHEMBL24334730 0.74 KMO (0.43) —
SCHEMBL22044253 0.74 KDM4E (0.49) CYP11B2CYP11B1
SCHEMBL22043776 0.74 MAPT (0.40) KIF11
SCHEMBL22043752 0.70 KDM4E (0.53) —
SCHEMBL24039051 0.70 PIK3CD (0.41) —

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220119359-A1 NOVEL TETRAZINE COMPOUNDS FOR IN VIVO IMAGING Københavns Universitet (DK) 2022-04-21 — — US disclosed
WO-2020108720-A1 NOVEL TETRAZINE COMPOUNDS FOR IN VIVO IMAGING Københavns Universitet (DK) 2020-06-04 — — WO 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-20220119359-A1 NOVEL TETRAZINE COMPOUNDS FOR IN VIVO IMAGING RTN3, RXFP3, TAAR5 KIF11 885/4885CYP11B2 2337/4885CYP11B1 2669/4885

“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.

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