SCHEMBL6501450

SCHEMBL6501450

Cc1ccc(-c2c(C)cccc2C(=O)Nc2ccc(N(CCc3csc(C)n3)C(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
KDM4E B2RXH2 3/20 0.43
STAT1 P42224 2/20 0.43
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
SMO Q99835 6/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
GAA P10253 1/20 0.38
MTTP P55157 9/20 0.37
APOB P04114 6/20 0.37
F2 P00734 1/20 0.36
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.35
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
KMT2A Q03164 1/20 0.35
RELA Q04206 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
SCHEMBL6488366 0.93 SMO (0.47) SMOMTTPAPOB
SCHEMBL6489780 0.91 PDE5A (0.38) NPC1RAB9AKDM4ESTAT1SMO
SCHEMBL6501137 0.85 PDE5A (0.39) NPC1RAB9AKDM4ESTAT1MAPT
SCHEMBL6489412 0.84 SMO (0.45) SMOMTTPAPOB
SCHEMBL6791537 0.82 GAA (0.48) NPC1RAB9AKDM4ESTAT1MAPT
SCHEMBL6499127 0.81 APOB (0.39) NPC1RAB9AKDM4EMAPTALDH1A1
SCHEMBL6795163 0.80 KMT2A (0.38) NPC1RAB9AKDM4ESTAT1MAPT
SCHEMBL6500792 0.80 NPC1 (0.52) NPC1RAB9AKDM4ESTAT1MAPT
SCHEMBL6497778 0.78 SREBF2 (0.38) MAPTALDH1A1SMN1; SMN2F2MEN1
SCHEMBL6491615 0.77 SREBF2 (0.39) NPC1RAB9AKDM4EMAPTALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors DAISO CO., LTD. (JP) 2005-02-17 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-20050038035-A1 Heterocyclic amide compounds as apolipoprotein b inhibitors APOB, APOL1, CTRB2 NPC1 100/4885RAB9A 4382/4885KDM4E 2286/4885

“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.