SCHEMBL21944908

SCHEMBL21944908

Oc1cc(F)cc(OCc2cc(Cl)cc(C(F)(F)F)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ IDO1 P14902 2/20 0.38
▸ MAOB P27338 3/20 0.38
▸ TACR1 P25103 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ POLB P06746 1/20 0.36
▸ HIF1A Q16665 1/20 0.36
▸ SLC13A3 Q8WWT9 1/20 0.36
▸ NR4A2 P43354 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ EPAS1 Q99814 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
SCHEMBL21944929 0.88 IDO1 (0.42) MRGPRX4L3MBTL1IDO1MAOBMAPT
SCHEMBL21945065 0.85 CYP4F2 (0.41) MRGPRX4IDO1MAOB
SCHEMBL21944794 0.82 IDO1 (0.42) MRGPRX4L3MBTL1IDO1MAOBMAPT
SCHEMBL21944924 0.82 MRGPRX4 (0.42) MRGPRX4L3MBTL1TDP1EPAS1
SCHEMBL18002794 0.82 MAOA (0.41) MRGPRX4L3MBTL1TDP1IDO1MAOB
SCHEMBL21945062 0.81 NR4A2 (0.49) MRGPRX4L3MBTL1MAOBMAPTPOLB
SCHEMBL21944825 0.80 IDO1 (0.53) MRGPRX4L3MBTL1IDO1MAOBTACR1
SCHEMBL21945045 0.80 MAOB (0.54) MRGPRX4IDO1MAOB
SCHEMBL21945509 0.79 MAOB (0.59) MRGPRX4L3MBTL1IDO1MAOBMAPT
SCHEMBL26604865 0.75 MRGPRX4 (0.46) MRGPRX4MAOBMAPTPOLBHIF1A

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 2 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

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 MRGPRX4 4062/4885L3MBTL1 1503/4885TDP1 2138/4885

“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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