SCHEMBL3315853

SCHEMBL3315853

Fc1nc2ccccn2c1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.56
ALDH1A1 P00352 9/20 0.56
GLA P06280 4/20 0.56
GAA P10253 4/20 0.56
HSD17B10 Q99714 4/20 0.56
NPC1 O15118 4/20 0.56
HPGD P15428 4/20 0.56
CASP1 P29466 1/20 0.56
CASP7 P55210 1/20 0.56
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 2/20 0.42
KMT2A Q03164 3/20 0.42
POLB P06746 2/20 0.42
MEN1 O00255 2/20 0.42
MAPT P10636 2/20 0.42
PTGS1 P23219 1/20 0.41
PTGS2 P35354 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41

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
SCHEMBL15004608 0.81 KMT2A (0.61) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL30172989 0.79 KDM4E (0.52) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL13050157 0.75 KDM4E (0.49) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL3861933 0.75 ALDH1A1 (0.51) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL15764112 0.75 ALDH1A1 (0.50) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL9517166 0.74 ALDH1A1 (0.46) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL1816550 0.74 KDM4E (0.68) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL13732765 0.72 ALDH1A1 (0.66) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL9517202 0.72 ALDH1A1 (0.44) KDM4EALDH1A1GLAGAAHSD17B10
SCHEMBL29174927 0.72 PTGS1 (0.61) KDM4EALDH1A1GLAGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100105655-A1 NOVEL COMPOUNDS 515 ASTRAZENECA AB 2010-04-29 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-20100105655-A1 NOVEL COMPOUNDS 515 TYMS, ABCG2, UMPS KDM4E 2169/4885ALDH1A1 649/4885GLA 2996/4885

“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.