SCHEMBL4255071

SCHEMBL4255071

O=C(NC1CCCc2c1[nH]c1ccc(Cl)cc21)c1cccc(F)n1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.75
ALOX15 P16050 4/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
MAPT P10636 3/20 0.64
MAPK1 P28482 1/20 0.64
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
GLA P06280 1/20 0.55
BRD3 Q15059 5/20 0.53
SIRT1 Q96EB6 8/20 0.52
SIRT2 Q8IXJ6 3/20 0.51
SIRT3 Q9NTG7 2/20 0.51
TSHR P16473 1/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 1/20 0.47

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
SCHEMBL4251737 0.89 DHODH (0.75) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4025228 0.85 DHODH (1.00) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4022761 0.85 DHODH (1.00) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL30338397 0.85 DHODH (1.00) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4025898 0.85 DHODH (1.00) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4022707 0.82 DHODH (0.72) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4022091 0.82 DHODH (0.69) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4022138 0.82 DHODH (0.75) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4021884 0.82 DHODH (0.69) DHODHALOX15SMN1; SMN2MAPTMAPK1
SCHEMBL4026687 0.82 DHODH (0.69) DHODHALOX15SMN1; SMN2MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170906-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US claimed
US-20090170906-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
US-20090170906-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 US disclosed
US-20090170906-A1 HCV INHIBITORS SMITHKLINE BEECHAM CORPORATION 2009-07-02 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-20090170906-A1 HCV INHIBITORS HAVCR2, MAVS, EIF2AK2 DHODH 103/4885ALOX15 1407/4885SMN1; SMN2 4443/4885

“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.