SCHEMBL3604179

SCHEMBL3604179

CC(C)(C)OC(=O)N1CCN(C(=O)Nc2cccc(Br)c2)C(CO)C1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.46
TP53 P04637 1/20 0.45
USP30 Q70CQ3 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 2/20 0.42
THRB P10828 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.42
EPHA2 P29317 1/20 0.42
PARP14 Q460N5 1/20 0.41
EPHX2 P34913 1/20 0.41
BACE1 P56817 1/20 0.41
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
FAAH O00519 1/20 0.40
LIMK2 P53671 2/20 0.40

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
SCHEMBL3592513 0.89 ALDH1A1 (0.47) CCR3USP30SMN1; SMN2MAPTMEN1
SCHEMBL3601902 0.88 ALDH1A1 (0.47) CCR3USP30SMN1; SMN2MAPTMEN1
SCHEMBL3609998 0.88 PARP14 (0.48) CCR3USP30MAPTMEN1KMT2A
SCHEMBL3601798 0.88 CCR3 (0.52) CCR3USP30MAPTMEN1KMT2A
SCHEMBL3605934 0.88 NAMPT (0.48) CCR3USP30MAPTMEN1KMT2A
SCHEMBL3608614 0.87 CCR3 (0.59) CCR3MAPTLMNAFAAH
SCHEMBL3600238 0.87 USP30 (0.49) CCR3TP53USP30SMN1; SMN2MAPT
SCHEMBL3596926 0.87 MAPT (0.51) CCR3USP30SMN1; SMN2MAPTMEN1
SCHEMBL3615203 0.87 MAPT (0.49) CCR3SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL3605374 0.86 CYP2D6 (0.48) CCR3USP30FAAH

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-20100004249-A1 Bicyclic heterocyclic compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-07 US disclosed
EP-2039695-A1 BICYCLIC HETEROCYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2009-03-25 EP 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-20100004249-A1 Bicyclic heterocyclic compound and use thereof HTR2C, HTR5A, HTR2A CCR3 2200/4885TP53 3547/4885USP30 4815/4885

“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.