SCHEMBL3601783

SCHEMBL3601783

CC(C)c1noc(N2CCC(CCCOc3ccc(C(=O)N[C@@H](C)CO)c(F)c3)CC2)n1.Cc1cc(OCCCC2CCN(c3noc(C(C)C)n3)CC2)ccc1C(=O)NC(CO)CO

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.43
KCNH2 Q12809 1/20 0.42
HRH3 Q9Y5N1 4/20 0.37
HDAC4 P56524 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
ACACB O00763 2/20 0.36
ACACA Q13085 2/20 0.36
GPR183 P32249 1/20 0.35

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
SCHEMBL2371717 0.89 GPR119 (0.51) GPR119KCNH2HRH3HDAC4HDAC6
SCHEMBL2370920 0.89 GPR119 (0.51) GPR119KCNH2HRH3GPR183
SCHEMBL2372004 0.89 GPR119 (0.51) GPR119KCNH2HRH3HDAC4HDAC6
SCHEMBL2372543 0.89 GPR119 (0.49) GPR119KCNH2HRH3HDAC4HDAC6
SCHEMBL2372433 0.89 GPR119 (0.51) GPR119KCNH2HRH3HDAC4HDAC6
SCHEMBL2372318 0.88 GPR119 (0.48) GPR119KCNH2HRH3GPR183
SCHEMBL2371581 0.88 GPR119 (0.48) GPR119KCNH2HRH3GPR183
SCHEMBL2370849 0.88 GPR119 (0.48) GPR119KCNH2HRH3GPR183
SCHEMBL2371332 0.88 GPR119 (0.42) GPR119HRH3HDAC4HDAC6ACACB
SCHEMBL2372242 0.88 ACACB (0.42) GPR119HRH3ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100022591-A1 PIPERIDINE GPCR AGONISTS PROSIDION LIMITED (GB) 2010-01-28 US claimed

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-20100022591-A1 PIPERIDINE GPCR AGONISTS GPR119, GPR27, GLP1R GPR119 1/4885KCNH2 1128/4885HRH3 432/4885

“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.