SCHEMBL18006175

SCHEMBL18006175

N#Cc1[nH]nnc1-c1cc(OCc2cccc(Cl)c2F)cc(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.35
ALOX5AP P20292 1/20 0.35
TLR8 Q9NR97 1/20 0.35
PTPN1 P18031 1/20 0.35
NR1H2 P55055 7/20 0.34
NR1H3 Q13133 2/20 0.33
TACR1 P25103 1/20 0.32
CTSS P25774 2/20 0.31
CTSK P43235 1/20 0.31
KMT2A Q03164 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
SCHEMBL18004410 0.91 NR1H2 (0.36) MRGPRX4ALOX5APTLR8NR1H2NR1H3
SCHEMBL18004323 0.91 ALOX5AP (0.42) ALOX5APTLR8NR1H2NR1H3TACR1
SCHEMBL18004430 0.88 SMN1; SMN2 (0.36) MRGPRX4ALOX5APNR1H2NR1H3KMT2A
SCHEMBL18006203 0.86 ALOX5AP (0.41) ALOX5APTLR8NR1H2
SCHEMBL18004165 0.85 NR1H2 (0.39) MRGPRX4ALOX5APNR1H2NR1H3
SCHEMBL18004448 0.85 NR1H2 (0.36) MRGPRX4ALOX5APNR1H2KMT2A
SCHEMBL18006172 0.85 INPPL1 (0.43) ALOX5APNR1H2KMT2A
SCHEMBL18004407 0.84 MAOB (0.39) ALOX5APNR1H2NR1H3
SCHEMBL18004444 0.84 GRIN1 (0.37) ALOX5AP
SCHEMBL18006186 0.84 CNR2 (0.37) NR1H2NR1H3KMT2A

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 MRGPRX4 4062/4885ALOX5AP 3601/4885TLR8 4399/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 MRGPRX4 4062/4885ALOX5AP 3601/4885TLR8 4399/4885

“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.