SCHEMBL2597085

SCHEMBL2597085

CC(=O)NNC(=O)c1ccc(OC2CCN(C3CCN(C(=O)OC(C)(C)C)CC3)C2=O)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
GPR119 Q8TDV5 5/20 0.44
FPR2 P25090 1/20 0.43
TP53 P04637 1/20 0.42
BRD4 O60885 1/20 0.40
PDE4D Q08499 3/20 0.39
PDE4A P27815 2/20 0.39
PDE4B Q07343 2/20 0.39
PDE4C Q08493 2/20 0.39
USP30 Q70CQ3 1/20 0.39
SCN9A Q15858 1/20 0.38
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
TOP2A P11388 1/20 0.37
HDAC4 P56524 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL15022866 1.00 KMT2A (0.48) KMT2AGPR119FPR2TP53BRD4
SCHEMBL14918034 0.88 KMT2A (0.37) KMT2AKDM4EALDH1A1
SCHEMBL14918071 0.88 GPR119 (0.47) KMT2AGPR119FPR2TP53PDE4D
SCHEMBL2597221 0.88 GPR119 (0.47) KMT2AGPR119FPR2TP53PDE4D
SCHEMBL2596996 0.87 GPR119 (0.48) KMT2AGPR119FPR2TP53PDE4D
SCHEMBL2596997 0.87 GPR119 (0.48) KMT2AGPR119FPR2TP53PDE4D
SCHEMBL27900665 0.87 HRH3 (0.35) KMT2AGPR119FPR2BRD4
SCHEMBL14917753 0.83 FPR2 (0.55) GPR119FPR2TP53PDE4DPDE4A
SCHEMBL790187 0.83 FPR2 (0.55) GPR119FPR2TP53PDE4DPDE4A
SCHEMBL789139 0.80 GPR119 (0.68) GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8754226-B2 Piperidinyl-substituted lactams as GPR119 modulators ARRAY BIOPHARMA INC. (US) 2014-06-17 US disclosed
US-20130158009-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA, INC. 2013-06-20 US disclosed
EP-2571864-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-03-27 EP disclosed
WO-2011146335-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2011-11-24 WO 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-20130158009-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS GPR119, GPR139, GPR39 KMT2A 1376/4885GPR119 1/4885FPR2 328/4885

“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.