SCHEMBL4842376

SCHEMBL4842376

COc1ccc2c(c1)/C(=C/C(=O)c1cccc(NC(=O)c3c(F)cccc3Cl)c1)NC(C)(C)C2

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
ALDH1A1 P00352 2/20 0.42
GAA P10253 1/20 0.42
MAOB P27338 1/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
TLR8 Q9NR97 5/20 0.39
TLR7 Q9NYK1 2/20 0.39
MAPK7 Q13164 1/20 0.37

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
SCHEMBL4842385 1.00 RAB9A (0.45) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL4839548 0.94 RAB9A (0.51) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL4839539 0.94 RAB9A (0.51) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL4835120 0.94 KMT2A (0.41) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL4835131 0.94 KMT2A (0.41) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL4846252 0.93 RAB9A (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL4846242 0.93 RAB9A (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1GAA
SCHEMBL4844236 0.91 RAB9A (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL4844247 0.91 RAB9A (0.44) RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL4839972 0.90 RAB9A (0.41) RAB9ANPC1SMN1; SMN2ALDH1A1GAA

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-7378428-B2 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-27 US disclosed
US-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 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-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient PARK7, MMP8, CDK7 RAB9A 2220/4885NPC1 985/4885SMN1; SMN2 144/4885

“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.