SCHEMBL3360449

SCHEMBL3360449

CCOCC1(C(=O)O)CCC(NC(=O)OC(C)(C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.42
KDM1A O60341 1/20 0.38
MAOB P27338 1/20 0.38
CTSK P43235 2/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSD11B1 P28845 9/20 0.36
EPHX1 P07099 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CYP2C9 P11712 1/20 0.34
KCNA3 P22001 1/20 0.34
GAA P10253 1/20 0.33

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
SCHEMBL4311560 1.00 BTK (0.42) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL4144914 1.00 BTK (0.42) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL3360452 1.00 BTK (0.42) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL3360456 1.00 BTK (0.42) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL3326571 0.87 BTK (0.46) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL3327036 0.87 BTK (0.46) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL14169680 0.87 BTK (0.46) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL14599256 0.85 BTK (0.38) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL14100704 0.85 BTK (0.44) BTKKDM1AMAOBCTSKKMT2A
SCHEMBL27517590 0.82 BTK (0.42) BTKKDM1AMAOBCTSKKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470827-B2 3-aminocyclopentanecarboxamides as modulators of chemokine receptors INCYTE CORPORATION (US) 2013-06-25 US disclosed
US-20100119503-A1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE CORPORATION (US) 2010-05-13 US disclosed
US-20090208485-A1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS INCYTE CORPORATION 2009-08-20 US disclosed
CN-1976702-A 3-aminocyclopentanecarboxamides as chemokine receptor modulators INCYTE CORP (US) 2007-06-06 CN disclosed
CN-1976707-A 3-aminocyclopentanecarboxamides as chemokine receptor modulators INCYTE CORP (US) 2007-06-06 CN 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-20100119503-A1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS CCR5, ACKR3, CXCR3 BTK 1970/4885KDM1A 4343/4885MAOB 3963/4885
US-20090208485-A1 3-AMINOCYCLOPENTANECARBOXAMIDES AS MODULATORS OF CHEMOKINE RECEPTORS CCR5, ACKR3, CXCR3 BTK 1970/4885KDM1A 4343/4885MAOB 3963/4885

“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.