SCHEMBL4846182

SCHEMBL4846182

COc1ccc2c(c1)C(=CC(=O)c1ccc(NC(=O)OCc3ccccc3)cc1)NC(C)(C)C2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 4/20 0.41
TP53 P04637 3/20 0.41
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 4/20 0.39
ALDH1A1 P00352 4/20 0.39
TSHR P16473 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
HTT P42858 1/20 0.39
FLT1 P17948 1/20 0.39
KDR P35968 1/20 0.39
FLT3 P36888 1/20 0.39
KDM1A O60341 2/20 0.39
RCOR1 Q9UKL0 1/20 0.39

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
SCHEMBL4846174 1.00 NPC1 (0.41) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL4843792 0.92 MGLL (0.42) RAB9ASMN1; SMN2LMNAKDM4EKDR
SCHEMBL4843800 0.92 MGLL (0.42) RAB9ASMN1; SMN2LMNAKDM4EKDR
SCHEMBL4841954 0.89 KDM4E (0.49) NPC1RAB9AMAPTLMNAKDM4E
SCHEMBL4841967 0.89 KDM4E (0.49) NPC1RAB9AMAPTLMNAKDM4E
SCHEMBL4835779 0.89 NAMPT (0.42) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL4835773 0.89 NAMPT (0.42) NPC1RAB9ASMN1; SMN2MAPTLMNA
SCHEMBL4839999 0.89 KDM4E (0.42) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL4839986 0.89 KDM4E (0.42) NPC1RAB9ASMN1; SMN2MAPTTP53
SCHEMBL4842405 0.88 RAB9A (0.51) NPC1RAB9ASMN1; SMN2MAPTLMNA

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 985/4885RAB9A 2220/4885SMN1; 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.