SCHEMBL3753086

SCHEMBL3753086

COC(=O)c1c(OC)ccc2ncc(-c3ccccc3)nc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
ALDH1A1 P00352 2/20 0.52
GLA P06280 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
PARP1 P09874 1/20 0.46
PLA2G2A P14555 1/20 0.44
TDO2 P48775 2/20 0.44
ABL1 P00519 2/20 0.44
YES1 P07947 2/20 0.44
DHODH Q02127 1/20 0.43
PDE10A Q9Y233 1/20 0.43
PIM1 P11309 1/20 0.42
MAPK1 P28482 1/20 0.42
HIPK1 Q86Z02 1/20 0.42
IDO1 P14902 1/20 0.41
HPGD P15428 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
SCHEMBL3521893 0.90 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1GLAGAAMAPT
SCHEMBL3520899 0.90 SMN1; SMN2 (0.55) SMN1; SMN2ALDH1A1GLAGAAMAPT
SCHEMBL3518290 0.81 NPSR1 (0.49) SMN1; SMN2ALDH1A1GAADHODHMAPK1
SCHEMBL3525048 0.80 TSHR (0.39) ALDH1A1
SCHEMBL3520739 0.80 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1GLAGAAMAPT
SCHEMBL3518631 0.79 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1GLAGAAMAPT
SCHEMBL3522740 0.77 DHODH (0.46) SMN1; SMN2ALDH1A1GAAMAPTPLA2G2A
SCHEMBL3519204 0.77 PLA2G2A (0.45) SMN1; SMN2ALDH1A1MAPTNPC1PLA2G2A
SCHEMBL3524998 0.74 ECE1 (0.52) ALDH1A1DHODH
SCHEMBL3758964 0.74 MEN1 (0.54) SMN1; SMN2GAAMAPTNPC1RAB9A

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
CN-101983384-A Prolyl hydroxylase inhibitors SMITHKLINE BEECHAM CORP 2011-03-02 CN disclosed
US-20100305133-A1 Prolyl Hydroxylase Inhibitors SMITHKLINE BEECHAM CORPORATION 2010-12-02 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-20100305133-A1 Prolyl Hydroxylase Inhibitors HIF1AN, EGLN3, EGLN2 SMN1; SMN2 3777/4885ALDH1A1 191/4885GLA 2045/4885

“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.