SCHEMBL7600293

SCHEMBL7600293

Cc1ccc(NC(=O)NCc2ccc(CN3C(=N)NC(C)(CC(C)C)C3=O)cc2)cc1Cl

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 7/20 0.53
CRBN Q96SW2 7/20 0.53
GSPT1 P15170 4/20 0.49
EPHX2 P34913 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
BACE1 P56817 1/20 0.45
ALDH1A1 P00352 1/20 0.43
IKZF3 Q9UKT9 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 1/20 0.41
MAPT P10636 1/20 0.41
PABPC1 P11940 1/20 0.41
S100A4 P26447 1/20 0.41
EIF4H Q15056 1/20 0.41

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
SCHEMBL8407934 0.94 DDB1 (0.46) DDB1CRBNGSPT1EPHX2SMN1; SMN2
SCHEMBL7523759 0.94 MAPT (0.46) DDB1CRBNGSPT1EPHX2SMN1; SMN2
SCHEMBL7518349 0.89 NAMPT (0.47) DDB1CRBNGSPT1EPHX2SMN1; SMN2
SCHEMBL7516737 0.89 POLB (0.48) DDB1CRBNSMN1; SMN2RAB9ANPC1
SCHEMBL7516813 0.89 NPC1 (0.53) SMN1; SMN2RAB9ANPC1BACE1ALDH1A1
SCHEMBL7518350 0.89 RAB9A (0.51) EPHX2SMN1; SMN2RAB9ANPC1BACE1
SCHEMBL7522639 0.88 RAB9A (0.55) SMN1; SMN2RAB9ANPC1BACE1ALDH1A1
SCHEMBL7517806 0.88 F7 (0.46) DDB1CRBNSMN1; SMN2RAB9ANPC1
SCHEMBL7523985 0.88 BACE1 (0.45) DDB1CRBNEPHX2SMN1; SMN2RAB9A
SCHEMBL7523275 0.88 ALDH1A1 (0.45) DDB1CRBNEPHX2SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183252-B2 Heterocyclic aspartyl protease inhibitors SCHERING CORPORATION (US) 2012-05-22 US disclosed
US-8178513-B2 Heterocyclic aspartyl protease inhibitors SCHERING CORPORATION (US) 2012-05-15 US disclosed
US-20100292203-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS SCHERING CORPORATION 2010-11-18 US disclosed
US-20090306047-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS SCHERING CORPORATION 2009-12-10 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 (2 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-20100292203-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS CHRM1, CHRM2, PRSS1 DDB1 4188/4885CRBN 2009/4885GSPT1 1480/4885
US-20090306047-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS PRSS1, BCHE, CTSZ DDB1 3876/4885CRBN 1420/4885GSPT1 1475/4885

“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.