SCHEMBL18006256

SCHEMBL18006256

Cc1ccc(OCc2cccc(-c3nn[nH]c3C#N)c2)cc1C

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.43
FFAR1 O14842 9/20 0.39
MAOB P27338 3/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
RAB9A P51151 1/20 0.37
CYP11B1 P15538 1/20 0.37
GAA P10253 1/20 0.36
RECQL P46063 1/20 0.36

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
SCHEMBL18006320 0.90 MRGPRX4 (0.41) MRGPRX4FFAR1MAOBCYP11B1
SCHEMBL18006254 0.89 FFAR1 (0.45) FFAR1MAOBCYP4F2CYP4A11CYP11B1
SCHEMBL18006253 0.88 MAOB (0.46) FFAR1MAOBRAB9A
SCHEMBL18006249 0.86 RAB9A (0.44) MRGPRX4FFAR1MAOBCYP4F2CYP4A11
SCHEMBL18006257 0.86 GRM5 (0.42) MRGPRX4FFAR1MAOBCYP4F2CYP4A11
SCHEMBL18006248 0.85 MAOB (0.49) MRGPRX4FFAR1MAOB
SCHEMBL18006262 0.85 ALOX5 (0.48) MRGPRX4MAOBRAB9AGAA
SCHEMBL18004687 0.85 NR4A2 (0.45) MRGPRX4FFAR1MAOBCYP4F2CYP4A11
SCHEMBL18006255 0.85 MAOB (0.45) FFAR1MAOBRAB9ACYP11B1
SCHEMBL18004697 0.84 MRGPRX4 (0.46) MRGPRX4FFAR1MAOBCYP4F2CYP4A11

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 4062/4885FFAR1 1292/4885MAOB 3664/4885
US-20160229816-A1 CYANOTRIAZOLE COMPOUNDS CS, PC, ACAT1 MRGPRX4 4062/4885FFAR1 1292/4885MAOB 3664/4885

“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.