SCHEMBL2419345

SCHEMBL2419345

CC(=O)N1CCC(CC(=O)Nc2ccc(-c3cc(F)cc(F)c3F)cn2)CC1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.50
DEGS1 O15121 3/20 0.49
WNT3A P56704 11/20 0.46
USP30 Q70CQ3 1/20 0.45
HDAC1 Q13547 1/20 0.43
HDAC2 Q92769 1/20 0.43
NPY5R Q15761 3/20 0.42

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
SCHEMBL2320672 0.88 WNT3A (0.53) ABL1DEGS1WNT3AUSP30HDAC1
SCHEMBL2418638 0.86 DEGS1 (0.43) ABL1DEGS1WNT3AHDAC1HDAC2
SCHEMBL2321207 0.85 USP30 (0.52) ABL1DEGS1WNT3AUSP30HDAC1
SCHEMBL2323322 0.81 DEGS1 (0.47) ABL1DEGS1WNT3AHDAC1HDAC2
SCHEMBL12283692 0.81 USP30 (0.55) ABL1DEGS1WNT3AUSP30HDAC1
SCHEMBL2315755 0.80 USP30 (0.52) ABL1DEGS1WNT3AUSP30HDAC1
SCHEMBL2317904 0.80 DEGS1 (0.53) ABL1DEGS1WNT3AUSP30HDAC1
SCHEMBL2319380 0.78 WNT3A (0.51) DEGS1WNT3AUSP30HDAC1HDAC2
SCHEMBL2319121 0.78 NPY5R (0.48) ABL1DEGS1WNT3AHDAC1HDAC2
SCHEMBL2317080 0.78 RAB9A (0.56) DEGS1USP30

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-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2011-09-22 US disclosed
US-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2011-09-22 US disclosed
US-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2011-09-22 US disclosed
WO-2010053861-A2 BIOLOGICALLY ACTIVE AMIDES H. LUNDBECK A/S (DK) 2010-05-14 WO 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-20110230497-A1 BIOLOGICALLY ACTIVE AMIDES NPY5R, NPY1R, NPY2R ABL1 985/4885DEGS1 3961/4885WNT3A 4719/4885

“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.