SCHEMBL18003454

SCHEMBL18003454

CCc1sc(-c2ccc(C(F)(F)F)cc2)nc1C(=O)OC

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.70
MAPT P10636 3/20 0.54
KDM4E B2RXH2 1/20 0.54
MEN1 O00255 1/20 0.54
HSP90AA1 P07900 1/20 0.54
CRHBP P24387 1/20 0.54
KMT2A Q03164 1/20 0.54
CRHR2 Q13324 1/20 0.54
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
PPARD Q03181 10/20 0.47
PPARA Q07869 9/20 0.47
PPARG P37231 5/20 0.47
FFAR1 O14842 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
SCHEMBL16399681 0.86 L3MBTL1 (0.68) L3MBTL1MAPTMEN1KMT2ANPC1
SCHEMBL18003089 0.86 L3MBTL1 (0.76) L3MBTL1MAPTKDM4EMEN1KMT2A
SCHEMBL16399060 0.84 L3MBTL1 (0.62) L3MBTL1MAPTKDM4EMEN1HSP90AA1
SCHEMBL18003085 0.84 L3MBTL1 (0.78) L3MBTL1MAPTKDM4EMEN1KMT2A
SCHEMBL16399399 0.83 L3MBTL1 (0.55) L3MBTL1MAPTKDM4EMEN1HSP90AA1
SCHEMBL18003913 0.83 L3MBTL1 (0.58) L3MBTL1MAPTKDM4EMEN1HSP90AA1
SCHEMBL18003992 0.83 MAPT (0.54) L3MBTL1MAPTKDM4EMEN1HSP90AA1
SCHEMBL18003676 0.83 L3MBTL1 (0.76) L3MBTL1MAPTKDM4EKMT2ANPC1
SCHEMBL18003464 0.82 L3MBTL1 (0.60) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL2946732 0.82 L3MBTL1 (0.78) L3MBTL1MAPTKDM4EMEN1KMT2A

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 L3MBTL1 1503/4885MAPT 2196/4885KDM4E 2681/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 L3MBTL1 1503/4885MAPT 2196/4885KDM4E 2681/4885

“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.