SCHEMBL3214955

SCHEMBL3214955

CCOC(=O)CCn1c(=O)ccc2ccc(F)cc21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KAT2B Q92831 1/20 0.43
ALDH1A1 P00352 3/20 0.42
FAAH O00519 1/20 0.42
HK1 P19367 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HKDC1 Q2TB90 1/20 0.42
LMNA P02545 1/20 0.42
KDM4E B2RXH2 2/20 0.41
MAPK14 Q16539 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TNF P01375 3/20 0.40
P2RX3 P56373 2/20 0.40
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL3405552 0.85 KAT2B (0.43) KAT2BALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL3403616 0.84 MTNR1A (0.46) KAT2BALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL3229548 0.83 ALDH1A1 (0.51) KAT2BALDH1A1KDM4ETNF
SCHEMBL3231703 0.82 LMNA (0.43) KAT2BALDH1A1LMNAKDM4EMEN1
SCHEMBL3218538 0.81 KDM4E (0.46) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL17580370 0.80 KDM4E (0.43) SMN1; SMN2LMNAKDM4EMAPK14
SCHEMBL28779597 0.79 HDAC1 (0.43) KAT2BALDH1A1KDM4EMAPTHPGD
SCHEMBL3229333 0.78 L3MBTL1 (0.44) KAT2BALDH1A1FAAHHK1SMN1; SMN2
SCHEMBL30448661 0.76 HDAC1 (0.43) KAT2BALDH1A1KDM4EHPGDHSD17B10
SCHEMBL3227880 0.76 KDM4E (0.49) ALDH1A1LMNAKDM4EMEN1KMT2A

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-20100056502-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-03-04 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-20100056502-A1 COMPOUNDS NRDC, NACA, NAA50 KAT2B 1406/4885ALDH1A1 4233/4885FAAH 2915/4885

“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.