SCHEMBL4841120

SCHEMBL4841120

COc1ccc2c(c1)/C(=C/C(=O)c1cccc(NC(=O)c3ccc(Cl)cc3)c1)NC(C)(C)C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.48
ALDH1A1 P00352 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 2/20 0.48
KDM4E B2RXH2 1/20 0.48
BLM P54132 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
NPC1 O15118 8/20 0.45
TP53 P04637 4/20 0.45
KMT2A Q03164 2/20 0.45
PKM P14618 1/20 0.45
KCNK9 Q9NPC2 2/20 0.44
NLRP3 Q96P20 1/20 0.43
CDYL2 Q8N8U2 1/20 0.42
CDYL Q9Y232 1/20 0.42
CDY1; CDY1B Q9Y6F8 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KCNK3 O14649 2/20 0.42
MET P08581 1/20 0.42
PTGS2 P35354 1/20 0.42

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
SCHEMBL4841134 1.00 RAB9A (0.48) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4843432 0.93 RAB9A (0.54) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4843742 0.93 RAB9A (0.47) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4843729 0.93 RAB9A (0.47) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4843420 0.93 RAB9A (0.54) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4839725 0.93 RAB9A (0.51) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4839736 0.93 RAB9A (0.51) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4846328 0.92 TP53 (0.48) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4846336 0.92 TP53 (0.48) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E
SCHEMBL4838059 0.92 KCNK3 (0.47) RAB9AALDH1A1SMN1; SMN2MAPTKDM4E

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 2636/4885SMN1; 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.