SCHEMBL18005267

SCHEMBL18005267

CC(C)c1oc(-c2ccc3c(c2)OC(F)(F)O3)nc1-c1nn[nH]c1C#N

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.42
UTRN P46939 1/20 0.37
PGGT1B P53609 2/20 0.35
FNTA P49354 2/20 0.34
FNTB P49356 2/20 0.34
GPR55 Q9Y2T6 1/20 0.33
KIT P10721 2/20 0.32
ALOX15 P16050 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
SCHEMBL18005433 0.88 NOTUM (0.44) NOTUMUTRNPGGT1BFNTAFNTB
SCHEMBL18005561 0.82 NOTUM (0.41) NOTUMUTRNPGGT1BKITALOX15
SCHEMBL18005405 0.82 ESR1 (0.35) ALOX15
SCHEMBL18005803 0.81 NOTUM (0.45) NOTUMUTRNPGGT1BFNTAFNTB
SCHEMBL16399478 0.81 KDM4E (0.45) NOTUMALOX15
SCHEMBL18005386 0.80 ALOX15 (0.45) NOTUMUTRNALOX15
SCHEMBL18005255 0.80 MAPK14 (0.36) NOTUMPGGT1BALOX15
SCHEMBL18004810 0.79 NOTUM (0.43) NOTUMUTRNPGGT1BFNTAFNTB
SCHEMBL16399661 0.79 KDM4E (0.41) NOTUMALOX15
SCHEMBL18005434 0.78 NOTUM (0.42) NOTUMUTRNPGGT1BFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4219477-A1 CYANOTRIAZOLE COMPOUNDS Otsuka Pharmaceutical Co., Ltd. (JP) 2023-08-02 EP disclosed
US-10626095-B2 Cyanotriazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2020-04-21 US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 US disclosed
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-11 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 (2 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 NOTUM 1379/4885UTRN 4246/4885PGGT1B 3728/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 NOTUM 1379/4885UTRN 4246/4885PGGT1B 3728/4885

“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.