SCHEMBL21945125

SCHEMBL21945125

C/N=C/c1[nH]nnc1-c1ccc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.32
▸ HSP90AA1 P07900 1/20 0.32
▸ HSP90AB1 P08238 1/20 0.32
▸ RXRA P19793 1/20 0.31
▸ RXRB P28702 1/20 0.31
▸ RXRG P48443 1/20 0.31
▸ DAO P14920 1/20 0.30

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
SCHEMBL21944766 0.88 PRMT6 (0.33) LTA4HDAO
SCHEMBL26070335 0.84 QPCT (0.32) LTA4H
SCHEMBL21945733 0.82 CYP1A2 (0.38) LTA4HDAO
SCHEMBL26070494 0.80 DAO (0.34) DAO
SCHEMBL21945716 0.77 PGR (0.34) RXRARXRBRXRG
SCHEMBL21945193 0.76 SLC6A2 (0.36) RXRARXRBRXRG
SCHEMBL26070403 0.76 GPR84 (0.35) —
SCHEMBL18004264 0.76 RXRA (0.36) LTA4HHSP90AA1HSP90AB1RXRARXRB
SCHEMBL21945136 0.76 KDM4E (0.40) HSP90AA1HSP90AB1
SCHEMBL26070407 0.76 TOP2A (0.33) DAO

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-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 — — 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-10626095-B2 Cyanotriazole compounds CS, PC, ACAT1 LTA4H 4154/4885HSP90AA1 3092/4885HSP90AB1 2713/4885

“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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