SCHEMBL5697485

SCHEMBL5697485

Cc1ccc(Oc2ccccc2)s1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 5/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
PPARG P37231 1/20 0.37
CA4 P22748 1/20 0.37
NR1H2 P55055 1/20 0.37
BAX Q07812 1/20 0.37
MAOA P21397 1/20 0.37
MRGPRX1 Q96LB2 1/20 0.37
HTT P42858 2/20 0.36
PGR P06401 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL5697493 0.77 MRGPRX1 (0.45) MRGPRX1
SCHEMBL17010926 0.77 LTA4H (0.50) LTA4HTSHRTDP1L3MBTL1CA4
SCHEMBL12168393 0.75 GUSB (0.33) SMN1; SMN2
SCHEMBL10950997 0.74 LTA4H (0.46) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL20708903 0.74 MAOA (0.46) LTA4HTSHRNR1H2BAXMAOA
SCHEMBL5697484 0.74 LTA4H (0.46) LTA4HTSHRTDP1L3MBTL1PPARG
SCHEMBL923385 0.74 LTA4H (0.41) LTA4HTSHRTDP1L3MBTL1PPARG
SCHEMBL922635 0.69 CYP2E1 (0.48) LTA4HTSHRMAOA
SCHEMBL6489226 0.69 MEN1 (0.46) LTA4HTSHR
SCHEMBL12351794 0.69 LTA4H (0.41) LTA4HTSHRPPARGNR1H2BAX

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10727534-B2 Electrolyte solution containing magnesium ions FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2020-07-28 US disclosed
US-20190131657-A1 ELECTROLYTE SOLUTION CONTAINING MAGNESIUM IONS FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-05-02 US disclosed
EP-1669348-A1 NOVEL ANTIFUNGAL AGENT COMPRISING HETEROCYCLIC COMPOUND Eisai Co., Ltd. (JP) 2006-06-14 EP 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-10727534-B2 Electrolyte solution containing magnesium ions MLX, PRDX1, PRDX6 LTA4H 2785/4885TSHR 2008/4885TDP1 2910/4885
US-20190131657-A1 ELECTROLYTE SOLUTION CONTAINING MAGNESIUM IONS MLX, PRDX1, PRDX6 LTA4H 2785/4885TSHR 2008/4885TDP1 2910/4885

“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.