SCHEMBL19938005

SCHEMBL19938005

CCC(=O)C(Cc1ccc(N)cc1)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
SOAT1 P35610 1/20 0.36
ESRRG P62508 1/20 0.36
PPIB P23284 1/20 0.36
PPIA P62937 1/20 0.36
PPID Q08752 1/20 0.36
PPIG Q13427 1/20 0.36
ITGB1 P05556 2/20 0.35
ITGA5 P08648 2/20 0.35
ITGB3 P05106 1/20 0.35
ITGAV P06756 1/20 0.35
FDPS P14324 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAOA P21397 1/20 0.35
GAA P10253 1/20 0.35
CA1 P00915 1/20 0.34

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
SCHEMBL10272387 0.85 ESR1 (0.45) ESRRGBLM
SCHEMBL1709296 0.83 CYP1A2 (0.46) RAB9ANPC1CYP1A2BLM
SCHEMBL19938004 0.81 EPHX2 (0.39) EPHX2RAB9ANPC1SOAT1ESRRG
SCHEMBL10272345 0.80 ACACB (0.47) EPHX2LMNA
SCHEMBL8042832 0.77 NPC1 (0.43) RAB9ANPC1SOAT1ITGB1ITGA5
SCHEMBL1709297 0.75 HTR2A (0.47) CYP1A2
SCHEMBL5608948 0.69 SLC7A5 (0.49) ESRRGCA2BLMEPHX1
SCHEMBL1937035 0.69 EPHX2 (0.37) EPHX2RAB9ANPC1SOAT1ESRRG
SCHEMBL19938026 0.69 GFER (0.42) RAB9ANPC1CYP3A4MAOAGFER
SCHEMBL19938012 0.68 TRPA1 (0.39) EPHX2RAB9ANPC1FDPSCYP3A4

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-20180066007-A1 Macrocyclic Compounds And Methods Of Making And Using The Same BioVersys AG (CH) 2018-03-08 US disclosed
US-20180066007-A1 Macrocyclic Compounds And Methods Of Making And Using The Same BioVersys AG (CH) 2018-03-08 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-20180066007-A1 Macrocyclic Compounds And Methods Of Making And Using The Same CCNO, PTGDR, CCNE1 EPHX2 504/4885RAB9A 1747/4885NPC1 813/4885

“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.