SCHEMBL4844346

SCHEMBL4844346

COc1ccc2c(c1)C(=CC(=O)c1ccc(NC(=O)c3c(F)ccc(F)c3F)cc1)NC(C)(C)C2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.37
NFE2L2 Q16236 1/20 0.37
BACE1 P56817 1/20 0.37
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPK14 Q16539 2/20 0.36
MAPT P10636 4/20 0.36
ALDH1A1 P00352 3/20 0.36
NPC1 O15118 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 0.36
HTT P42858 1/20 0.36
HPGD P15428 2/20 0.36
TP53 P04637 1/20 0.35
ALOX15 P16050 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.35

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
SCHEMBL4844336 1.00 RAB9A (0.37) RAB9ANFE2L2BACE1LMNAKDM4E
SCHEMBL4844433 0.92 RAB9A (0.47) RAB9ALMNAKDM4EMAPTALDH1A1
SCHEMBL4844423 0.92 RAB9A (0.47) RAB9ALMNAKDM4EMAPTALDH1A1
SCHEMBL4844247 0.91 RAB9A (0.44) RAB9AALDH1A1NPC1HTTTP53
SCHEMBL4844236 0.91 RAB9A (0.44) RAB9AALDH1A1NPC1HTTTP53
SCHEMBL4842104 0.91 STIM1 (0.37) RAB9ANFE2L2BACE1LMNAKDM4E
SCHEMBL4842095 0.91 STIM1 (0.37) RAB9ANFE2L2BACE1LMNAKDM4E
SCHEMBL4841019 0.90 NPC1 (0.39) RAB9ANFE2L2BACE1LMNAKDM4E
SCHEMBL4841008 0.90 NPC1 (0.39) RAB9ANFE2L2BACE1LMNAKDM4E
SCHEMBL4846242 0.89 RAB9A (0.44) RAB9AKDM4EMAPTALDH1A1NPC1

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 2220/4885NFE2L2 1343/4885BACE1 146/4885

“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.