SCHEMBL4835212

SCHEMBL4835212

COc1ccc2c(c1)C(=CC(=O)c1cccc(NC(=O)C=C(C)C)c1)NC(C)(C)C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.46
MEN1 O00255 3/20 0.46
NPC1 O15118 5/20 0.41
RAB9A P51151 4/20 0.41
LMNA P02545 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 3/20 0.41
HTT P42858 1/20 0.41
ALDH1A1 P00352 5/20 0.39
CDYL2 Q8N8U2 1/20 0.38
CDYL Q9Y232 1/20 0.38
CDY1; CDY1B Q9Y6F8 1/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP1A2 P05177 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2D6 P10635 2/20 0.37
CYP2C9 P11712 2/20 0.37
CYP2C19 P33261 2/20 0.37
MITF O75030 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL4835203 1.00 KMT2A (0.46) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4839226 0.91 TSHR (0.45) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4839243 0.91 TSHR (0.45) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4834891 0.90 MAPT (0.41) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4834906 0.90 MAPT (0.41) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4846019 0.90 MTNR1A (0.45) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4846009 0.90 MTNR1A (0.45) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4844317 0.88 KMT2A (0.43) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL4839736 0.88 RAB9A (0.51) KMT2AMEN1NPC1RAB9ASMN1; SMN2
SCHEMBL4837741 0.88 RAB9A (0.52) KMT2AMEN1NPC1RAB9ASMN1; SMN2

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 KMT2A 4642/4885MEN1 1230/4885NPC1 985/4885

“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.