SCHEMBL21944798

SCHEMBL21944798

Oc1ccc(-c2cccc(OCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)c2)s1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 2/20 0.45
▸ MAOB P27338 8/20 0.45
▸ MAPT P10636 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ HTT P42858 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ MRGPRX4 Q96LA9 1/20 0.43
▸ HIF1A Q16665 1/20 0.42
▸ LMNA P02545 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ PLAT P00750 1/20 0.40
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ PTPRB P23467 1/20 0.40
▸ PTPN6 P29350 1/20 0.40
▸ PTPN11 Q06124 1/20 0.40
▸ TACR1 P25103 1/20 0.40

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
SCHEMBL21944881 0.90 PPARD (0.46) NR4A2MAOBMAPTPOLBHTT
SCHEMBL18002385 0.82 MAPT (0.46) NR4A2MAOBMAPTPOLBHTT
SCHEMBL21945003 0.81 SRD5A2 (0.47) MAOBLMNAPKMHSD17B10
SCHEMBL18005437 0.74 NR4A2 (0.37) NR4A2MAOBMRGPRX4HIF1ALMNA
SCHEMBL21945062 0.74 NR4A2 (0.49) NR4A2MAOBMAPTPOLBHTT
SCHEMBL18002002 0.72 POLB (0.46) NR4A2MAOBMAPTPOLBMRGPRX4
SCHEMBL21945000 0.71 SRD5A2 (0.55) NR4A2MAOBMRGPRX4
SCHEMBL21944801 0.71 MAOB (0.43) NR4A2MAOBMAPTPOLBHTT
SCHEMBL18002486 0.71 MAPT (0.47) NR4A2MAOBMAPTPOLBHTT
SCHEMBL21944825 0.70 IDO1 (0.53) NR4A2MAOBMAPTPOLBHTT

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 NR4A2 2048/4885MAOB 3664/4885MAPT 2196/4885

“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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