SCHEMBL4846599

SCHEMBL4846599

CCOc1ccc(C(=O)Nc2ccc(C(=O)/C=C3\NC(C)(C)Cc4ccc(OC)cc43)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.53
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP1A2 P05177 1/20 0.53
RAB9A P51151 6/20 0.48
MAPT P10636 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
POLB P06746 2/20 0.48
KMT2A Q03164 8/20 0.47
MEN1 O00255 6/20 0.47
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
LMNA P02545 3/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 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
SCHEMBL4846605 1.00 NPC1 (0.53) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4840622 0.93 MEN1 (0.48) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4840613 0.93 MEN1 (0.48) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4839109 0.93 RAB9A (0.49) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4839102 0.93 RAB9A (0.49) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4842638 0.92 MEN1 (0.47) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4844982 0.92 NPC1 (0.48) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4842629 0.92 MEN1 (0.47) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4844969 0.92 NPC1 (0.48) NPC1KDM4EALDH1A1CYP1A2RAB9A
SCHEMBL4835293 0.91 KCNA5 (0.41) NPC1KDM4EALDH1A1CYP1A2RAB9A

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 NPC1 985/4885KDM4E 4466/4885ALDH1A1 2636/4885

“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.