SCHEMBL2290898

SCHEMBL2290898

O/N=C/c1c(-c2ccccc2)n(-c2ccc(O)cc2)c2ccc(F)cc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.39
CACNG8 Q8WXS5 1/20 0.39
CACNG2 Q9Y698 1/20 0.39
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
ESR2 Q92731 2/20 0.37
ESR1 P03372 1/20 0.37
LMNA P02545 3/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
KMT2A Q03164 1/20 0.34
GAA P10253 2/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33

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
SCHEMBL2144967 1.00 GRIA1 (0.39) GRIA1CACNG8CACNG2JAK2JAK3
SCHEMBL2146435 0.85 MAPT (0.46) GRIA1CACNG8CACNG2KDM4ENPC1
SCHEMBL2146432 0.85 MAPT (0.46) GRIA1CACNG8CACNG2KDM4ENPC1
SCHEMBL5070804 0.81 POLB (0.40) GRIA1CACNG8CACNG2KDM4EMAPT
SCHEMBL5069177 0.81 POLB (0.40) GRIA1CACNG8CACNG2KDM4EMAPT
SCHEMBL5069179 0.81 POLB (0.40) GRIA1CACNG8CACNG2KDM4EMAPT
SCHEMBL2286114 0.79 LMNA (0.36) GRIA1CACNG8CACNG2JAK2JAK3
SCHEMBL2146555 0.79 LMNA (0.36) GRIA1CACNG8CACNG2JAK2JAK3
SCHEMBL2148993 0.78 ESR2 (0.40) GRIA1CACNG8CACNG2KDM4ENPC1
SCHEMBL2148990 0.78 ESR2 (0.40) GRIA1CACNG8CACNG2KDM4ENPC1

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
US-20110201555-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-08-18 US claimed
US-20110201555-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-08-18 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-20110201555-A1 NOVEL ESTROGEN RECEPTOR LIGANDS ESR1, ESRRA, GPER1 GRIA1 208/4885CACNG8 2304/4885CACNG2 3788/4885

“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.