SCHEMBL29973124

SCHEMBL29973124

CCOC(=O)CC1CN(c2ccnc(C)c2)C1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 9/20 0.54
CHRM2 P08172 4/20 0.45
AOC3 Q16853 1/20 0.40
F10 P00742 2/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
TMEM97 Q5BJF2 1/20 0.37
ACACB O00763 1/20 0.37
PIK3CA P42336 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
F2 P00734 1/20 0.36
PLAT P00750 1/20 0.36
KLKB1 P03952 1/20 0.36

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
SCHEMBL7010881 0.88 LDHA (0.45) CHRM4AOC3F10JAK2JAK1
SCHEMBL31614778 0.88 MGLL (0.44) CHRM4CHRM2PIK3CAKMT2AMAPK1
SCHEMBL30455908 0.86 CHRM4 (0.57) CHRM4CHRM2ACACBKMT2A
SCHEMBL29973458 0.84 CHRM4 (0.57) CHRM4CHRM2ACACB
SCHEMBL21847675 0.84 CHRM4 (0.57) CHRM4CHRM2JAK2JAK1TYK2
SCHEMBL21847696 0.84 CHRM4 (0.57) CHRM4CHRM2ACACBKMT2ACYP1A2
SCHEMBL31647857 0.84 CHRM4 (0.49) CHRM4F10KMT2A
SCHEMBL20594817 0.84 CHRM4 (0.58) CHRM4CHRM2F10TMEM97CYP1A2
SCHEMBL29839994 0.84 CHRM4 (0.58) CHRM4CHRM2F10TMEM97CYP1A2
SCHEMBL21847855 0.83 CHRM4 (0.60) CHRM4CHRM2ACACB

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
WO-2025122809-A1 M4 POSITIVE ALLOSTERIC MODULATORS ACADIA PHARMACEUTICALS INC. (US) 2025-06-12 WO disclosed
EP-3642202-B1 DIHYDRO-PYRROLO-PYRIDINE DERIVATIVES PFIZER (US) 2022-11-02 EP disclosed