SCHEMBL4842417

SCHEMBL4842417

COc1ccc2c(c1)C(=CC(=O)c1ccc(NC(=O)Cc3ccccc3)cc1)NC(C)(C)C2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
KMT2A Q03164 6/20 0.48
MEN1 O00255 5/20 0.48
USP2 O75604 1/20 0.46
NPC1 O15118 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 2/20 0.42
GAA P10253 2/20 0.42
LMNA P02545 2/20 0.41
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
HTT P42858 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CACNA1B Q00975 1/20 0.40
APBA1 Q02410 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP1A2 P05177 1/20 0.40

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
SCHEMBL4842405 1.00 RAB9A (0.51) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4844791 0.95 KMT2A (0.50) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4844798 0.95 KMT2A (0.50) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4839782 0.92 USP2 (0.52) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4839756 0.92 USP2 (0.52) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4842151 0.92 KMT2A (0.45) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4846573 0.92 RAB9A (0.48) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4846566 0.92 RAB9A (0.48) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4842139 0.92 KMT2A (0.45) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4835779 0.90 NAMPT (0.42) RAB9AALDH1A1MAPTSMN1; SMN2KMT2A

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 2220/4885ALDH1A1 2636/4885MAPT 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.