SCHEMBL4839976

SCHEMBL4839976

COc1ccc2c(c1)C(=CC(=O)c1cccc(NC(=O)c3c(Cl)cc(Cl)cc3Cl)c1)NC(C)(C)C2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.41
NPC1 O15118 4/20 0.41
MAPT P10636 4/20 0.41
TP53 P04637 3/20 0.41
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
HTT P42858 1/20 0.41
RECQL P46063 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CDYL2 Q8N8U2 1/20 0.40
CDYL Q9Y232 1/20 0.40
CDY1; CDY1B Q9Y6F8 1/20 0.40
ALDH1A1 P00352 3/20 0.38
TGM2 P21980 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 1/20 0.38
BLM P54132 1/20 0.38

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
SCHEMBL4839972 1.00 RAB9A (0.41) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4835120 0.95 KMT2A (0.41) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4835131 0.95 KMT2A (0.41) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4843729 0.92 RAB9A (0.47) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4843742 0.92 RAB9A (0.47) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4842248 0.90 MAPT (0.54) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4842240 0.90 MAPT (0.54) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4841120 0.90 RAB9A (0.48) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4841134 0.90 RAB9A (0.48) RAB9ANPC1MAPTTP53KMT2A
SCHEMBL4843432 0.90 RAB9A (0.54) RAB9ANPC1MAPTTP53KMT2A

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 985/4885MAPT 646/4885

“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.