SCHEMBL30187336

SCHEMBL30187336

Cc1nnc2oc3c(NCc4cccc(C(C)(C)O)c4)ncnc3c2c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 8/20 0.60
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 4/20 0.43
HSD17B10 Q99714 4/20 0.43
MAPK1 P28482 2/20 0.43
MEN1 O00255 1/20 0.43
USP2 O75604 1/20 0.43
KMT2A Q03164 1/20 0.43
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.40
AURKA O14965 3/20 0.40
RPS6KB1 P23443 3/20 0.40
TP53 P04637 1/20 0.39
CCNB2 O95067 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CDK2 P24941 1/20 0.38

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
SCHEMBL19740854 1.00 CHRM4 (0.60) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL19741047 0.89 CHRM4 (0.74) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30187677 0.86 CHRM4 (0.81) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL19741206 0.86 CHRM4 (0.81) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL19741132 0.84 CHRM4 (0.59) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30187862 0.84 CHRM4 (0.59) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30187346 0.83 CHRM4 (0.58) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL19740855 0.83 CHRM4 (0.65) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30193752 0.83 CHRM4 (0.65) CHRM4KDM4EALDH1A1HPGDHSD17B10
SCHEMBL19741016 0.83 CHRM4 (0.58) CHRM4KDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109310668-B Positive allosteric modulators of muscarinic acetylcholine receptor M4 范德比尔特大学 2023-01-24 CN claimed
US-20250026764-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 UNIV VANDERBILT (US) 2025-01-23 US disclosed
US-20230348490-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2023-11-02 US disclosed
CN-116178391-A Forward allosteric modulators of muscarinic acetylcholine receptor M4 范德比尔特大学 2023-05-30 CN disclosed
CN-109310668-B Positive allosteric modulators of muscarinic acetylcholine receptor M4 范德比尔特大学 2023-01-24 CN disclosed
US-20230014109-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2023-01-19 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 (3 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-20230014109-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM5, CHRM2 CHRM4 1/4885KDM4E 894/4885ALDH1A1 3751/4885
US-20230348490-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM5, CHRM2 CHRM4 1/4885KDM4E 894/4885ALDH1A1 3751/4885
US-20250026764-A1 POSITIVE ALLOSTERIC MODULATORS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM4, CHRM5, CHRM2 CHRM4 1/4885KDM4E 894/4885ALDH1A1 3751/4885

“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.