SCHEMBL18848883

SCHEMBL18848883

CC(C)(F)CN1CCC(COc2ccc(-c3ccc(C(=O)N4CC[C@@H](O)C4)cc3)cc2C#N)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
XDH P47989 5/20 0.43
HRH3 Q9Y5N1 3/20 0.42
HDAC4 P56524 1/20 0.40
KDM1A O60341 4/20 0.39
GPR119 Q8TDV5 1/20 0.39
TLR9 Q9NR96 1/20 0.39
TLR8 Q9NR97 1/20 0.39
TLR7 Q9NYK1 1/20 0.39
PDK2 Q15119 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
SCHEMBL15539987 1.00 XDH (0.43) XDHHRH3HDAC4KDM1AGPR119
SCHEMBL15539988 1.00 XDH (0.43) XDHHRH3HDAC4KDM1AGPR119
SCHEMBL15537879 0.95 XDH (0.44) XDHHRH3KDM1A
SCHEMBL15538753 0.95 XDH (0.44) XDHHRH3KDM1A
SCHEMBL15537880 0.95 XDH (0.44) XDHHRH3KDM1A
SCHEMBL15538882 0.92 XDH (0.42) XDHHRH3HDAC4KDM1ATLR9
SCHEMBL15538885 0.92 XDH (0.42) XDHHRH3HDAC4KDM1ATLR9
SCHEMBL21534990 0.90 XDH (0.46) XDHHRH3GPR119
SCHEMBL18849080 0.90 PIK3CA (0.40) XDHKDM1AGPR119
SCHEMBL15539591 0.90 PIK3CA (0.40) XDHKDM1AGPR119

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-9776987-B2 Amide derivatives for GPR119 agonist CHONG KUN DANG PHARMACEUTICAL CORP (KR) 2017-10-03 US disclosed
US-20170129875-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2017-05-11 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 (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-20170129875-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST GPR119, FFAR2, GLP1R XDH 3886/4885HRH3 380/4885HDAC4 1241/4885

“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.